N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide

C11H9N3O2S — CID 60716919

IUPACN-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCC(=O)c1csc(NC(=O)c2cccnc2)n1
InChIInChI=1S/C11H9N3O2S/c1-7(15)9-6-17-11(13-9)14-10(16)8-3-2-4-12-5-8/h2-6H,1H3,(H,13,14,16)
InChIKeyQXNGBWUEAOQSFR-UHFFFAOYSA-N
MW247.28 g/mol
LogP1.99
Rot. Bonds3

About N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide

N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 60716919) has the molecular formula C11H9N3O2S and a molecular weight of 247.28 g/mol. Its IUPAC name is N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID60716919
Molecular FormulaC11H9N3O2S
Molecular Weight247.28 g/mol
Exact Mass247.04
IUPAC NameN-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCC(=O)c1csc(NC(=O)c2cccnc2)n1
InChIInChI=1S/C11H9N3O2S/c1-7(15)9-6-17-11(13-9)14-10(16)8-3-2-4-12-5-8/h2-6H,1H3,(H,13,14,16)
InChIKeyQXNGBWUEAOQSFR-UHFFFAOYSA-N
XLogP1.99
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.28
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46674310
N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
CID 60700131
N-(4-acetyl-1,3-thiazol-2-yl)-4-propan-2-ylbenzamide
CID 24555772
N-(3-acetylphenyl)-2-(pyridin-3-ylamino)-1,3-thiazole-4-carboxamide
CID 90510250
N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide
CID 1358652
N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 693380
N-(4-acetyl-1,3-thiazol-2-yl)-3-hydroxy-4-methylbenzamide
CID 64544456
N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-2-carboxamide
CID 26469458
N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;hydrochloride
CID 110756954
N-(4-acetyl-1,3-thiazol-2-yl)-4-bromo-3-methylbenzamide
CID 112706110
4-(acetamidomethyl)-N-(4-acetyl-1,3-thiazol-2-yl)benzamide
CID 43033822
N-(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
CID 14700265

Frequently Asked Questions

What is the IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 60716919) is N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide is CC(=O)c1csc(NC(=O)c2cccnc2)n1.
What is the InChIKey of N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is QXNGBWUEAOQSFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2S/c1-7(15)9-6-17-11(13-9)14-10(16)8-3-2-4-12-5-8/h2-6H,1H3,(H,13,14,16).
What are the key properties of N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 247.28 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 60716919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).