2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide

C15H18ClN3OS2 — CID 119558785

IUPAC2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide
SMILESO=C(NCCC1CCCNC1)c1csc(-c2ccc(Cl)s2)n1
InChIInChI=1S/C15H18ClN3OS2/c16-13-4-3-12(22-13)15-19-11(9-21-15)14(20)18-7-5-10-2-1-6-17-8-10/h3-4,9-10,17H,1-2,5-8H2,(H,18,20)
InChIKeyYTQCXINSFVHXJZ-UHFFFAOYSA-N
MW355.92 g/mol
LogP3.64
Rot. Bonds5

About 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide

2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide (PubChem CID 119558785) has the molecular formula C15H18ClN3OS2 and a molecular weight of 355.92 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide
PubChem CID119558785
Molecular FormulaC15H18ClN3OS2
Molecular Weight355.92 g/mol
Exact Mass355.06
IUPAC Name2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide
SMILESO=C(NCCC1CCCNC1)c1csc(-c2ccc(Cl)s2)n1
InChIInChI=1S/C15H18ClN3OS2/c16-13-4-3-12(22-13)15-19-11(9-21-15)14(20)18-7-5-10-2-1-6-17-8-10/h3-4,9-10,17H,1-2,5-8H2,(H,18,20)
InChIKeyYTQCXINSFVHXJZ-UHFFFAOYSA-N
XLogP3.64
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.92
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide 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 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide (CID 119558785) is 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide is O=C(NCCC1CCCNC1)c1csc(-c2ccc(Cl)s2)n1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is YTQCXINSFVHXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3OS2/c16-13-4-3-12(22-13)15-19-11(9-21-15)14(20)18-7-5-10-2-1-6-17-8-10/h3-4,9-10,17H,1-2,5-8H2,(H,18,20).
What are the key properties of 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide?
2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 355.92 g/mol, XLogP of 3.64, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 119558785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).