1-Piperazinepropanamide, N-(2-aminophenyl)-4-(2-pyridinyl)-

Modify Date: 2025-08-30 19:06:05

1-Piperazinepropanamide, N-(2-aminophenyl)-4-(2-pyridinyl)- Structure
1-Piperazinepropanamide, N-(2-aminophenyl)-4-(2-pyridinyl)- structure
Common Name 1-Piperazinepropanamide, N-(2-aminophenyl)-4-(2-pyridinyl)-
CAS Number 86523-91-3 Molecular Weight 325.40800
Density 1.235g/cm3 Boiling Point 589.9ºC at 760 mmHg
Molecular Formula C18H23N5O Melting Point N/A
MSDS N/A Flash Point 310.5ºC

 Names

Name N-(2-aminophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide

 Chemical & Physical Properties

Density 1.235g/cm3
Boiling Point 589.9ºC at 760 mmHg
Molecular Formula C18H23N5O
Molecular Weight 325.40800
Flash Point 310.5ºC
Exact Mass 325.19000
PSA 77.98000
LogP 3.04820
Index of Refraction 1.645
InChIKey WTRZHMOEKZFPLO-UHFFFAOYSA-N
SMILES Nc1ccccc1NC(=O)CCN1CCN(c2ccccn2)CC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TM2647420
CHEMICAL NAME :
1-Piperazinepropanamide, N-(2-aminophenyl)-4-(2-pyridinyl)-
CAS REGISTRY NUMBER :
86523-91-3
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C18-H23-N5-O
MOLECULAR WEIGHT :
325.46

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
677 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 30,13,1987
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1041 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 30,13,1987

 Safety Information

HS Code 2933990090

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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