2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

C15H10ClN3OS — CID 10448430

IUPAC2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nccs1)c1cc(-c2ccccc2)cnc1Cl
InChIInChI=1S/C15H10ClN3OS/c16-13-12(14(20)19-15-17-6-7-21-15)8-11(9-18-13)10-4-2-1-3-5-10/h1-9H,(H,17,19,20)
InChIKeyNLKAHYDHIHVVTI-UHFFFAOYSA-N
MW315.79 g/mol
LogP4.11
Rot. Bonds3

About 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 10448430) has the molecular formula C15H10ClN3OS and a molecular weight of 315.79 g/mol. Its IUPAC name is 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID10448430
Molecular FormulaC15H10ClN3OS
Molecular Weight315.79 g/mol
Exact Mass315.02
IUPAC Name2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nccs1)c1cc(-c2ccccc2)cnc1Cl
InChIInChI=1S/C15H10ClN3OS/c16-13-12(14(20)19-15-17-6-7-21-15)8-11(9-18-13)10-4-2-1-3-5-10/h1-9H,(H,17,19,20)
InChIKeyNLKAHYDHIHVVTI-UHFFFAOYSA-N
XLogP4.11
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.79
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
2-(propan-2-ylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 63107522
3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361308
2-methyl-4-phenyl-3-(1,3-thiazol-2-ylcarbamoyl)benzoic acid
CID 91062779
2-chloro-N-(1,3-thiazol-2-yl)-3-(trifluoromethyl)quinoline-8-carboxamide
CID 87189840
4-amino-3-phenyl-N-(1,3-thiazol-2-yl)benzamide
CID 86046995
3-(3-bromophenyl)-1-phenyl-N-(1,3-thiazol-2-yl)pyrazole-4-carboxamide
CID 1287471
3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361254
2-[(2-methylpropan-2-yl)oxy]-N-(1,3-thiazol-2-yl)benzamide
CID 110464702
5-chloro-2-(methylamino)-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 114921694
2,3-difluoro-N-(1,3-thiazol-2-yl)benzamide
CID 62650804
2-(4-fluorophenyl)-N-(1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 2322249

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 10448430) is 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide is O=C(Nc1nccs1)c1cc(-c2ccccc2)cnc1Cl.
What is the InChIKey of 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is NLKAHYDHIHVVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3OS/c16-13-12(14(20)19-15-17-6-7-21-15)8-11(9-18-13)10-4-2-1-3-5-10/h1-9H,(H,17,19,20).
What are the key properties of 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 315.79 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-phenyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 10448430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).