N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride

C15H19Cl2N3OS2 — CID 119565568

IUPACN-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride
SMILESCc1nc(-c2ccc(Cl)s2)sc1C(=O)NC1(CN)CCCC1.Cl
InChIInChI=1S/C15H18ClN3OS2.ClH/c1-9-12(13(20)19-15(8-17)6-2-3-7-15)22-14(18-9)10-4-5-11(16)21-10;/h4-5H,2-3,6-8,17H2,1H3,(H,19,20);1H
InChIKeyMCDYNHFZDGFIPA-UHFFFAOYSA-N
MW392.38 g/mol
LogP4.26
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride

N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride (PubChem CID 119565568) has the molecular formula C15H19Cl2N3OS2 and a molecular weight of 392.38 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride
PubChem CID119565568
Molecular FormulaC15H19Cl2N3OS2
Molecular Weight392.38 g/mol
Exact Mass391.03
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride
SMILESCc1nc(-c2ccc(Cl)s2)sc1C(=O)NC1(CN)CCCC1.Cl
InChIInChI=1S/C15H18ClN3OS2.ClH/c1-9-12(13(20)19-15(8-17)6-2-3-7-15)22-14(18-9)10-4-5-11(16)21-10;/h4-5H,2-3,6-8,17H2,1H3,(H,19,20);1H
InChIKeyMCDYNHFZDGFIPA-UHFFFAOYSA-N
XLogP4.26
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.38
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride (CID 119565568) is N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride is Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NC1(CN)CCCC1.Cl.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride?
The InChIKey is MCDYNHFZDGFIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3OS2.ClH/c1-9-12(13(20)19-15(8-17)6-2-3-7-15)22-14(18-9)10-4-5-11(16)21-10;/h4-5H,2-3,6-8,17H2,1H3,(H,19,20);1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride?
N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride has a molecular weight of 392.38 g/mol, XLogP of 4.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-(5-chlorothiophen-2-yl)-4-methyl-1,3-thiazole-5-carboxamide;hydrochloride is sourced from PubChem (CID 119565568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).