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

C16H12N4O2S — CID 11045566

IUPAC3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1cccnc1C(=O)Nc1nccs1)c1ccccc1
InChIInChI=1S/C16H12N4O2S/c21-14(11-5-2-1-3-6-11)19-12-7-4-8-17-13(12)15(22)20-16-18-9-10-23-16/h1-10H,(H,19,21)(H,18,20,22)
InChIKeyBOMLSFCDGFXWEI-UHFFFAOYSA-N
MW324.37 g/mol
LogP3.04
Rot. Bonds4

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

3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide (PubChem CID 11045566) has the molecular formula C16H12N4O2S and a molecular weight of 324.37 g/mol. Its IUPAC name is 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
PubChem CID11045566
Molecular FormulaC16H12N4O2S
Molecular Weight324.37 g/mol
Exact Mass324.07
IUPAC Name3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESO=C(Nc1cccnc1C(=O)Nc1nccs1)c1ccccc1
InChIInChI=1S/C16H12N4O2S/c21-14(11-5-2-1-3-6-11)19-12-7-4-8-17-13(12)15(22)20-16-18-9-10-23-16/h1-10H,(H,19,21)(H,18,20,22)
InChIKeyBOMLSFCDGFXWEI-UHFFFAOYSA-N
XLogP3.04
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.37
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-Pyridinecarboxamide, N-(4-phenyl-2-thiazolyl)-
CID 203433
6-cyclopropyl-N-[3-(cyclopropylcarbamoyl)thiophen-2-yl]-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
CID 58548356
3-((2,2-Dimethylpropanoyl)amino)-N-1,3-thiazol-2-ylpyridine-2-carboxamide
CID 11120251
Tert-butyl {2-[(1,3-thiazol-2-ylamino)carbonyl]pyridin-3-YL}carbamate
CID 11809364
N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 790259
N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 506605
2-Ethyl-9-methyl-13-[2-(1,3-thiazol-2-yl)ethyl]-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
CID 470733
N-(4-Pyridin-2-yl-thiazol-2-yl)-benzamide
CID 4119262
indole-based 6-membered lactam, (R)-4b
CID 15604766
N-(2,6-dimethylphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide
CID 21911586
2-[(4-Methyl-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-carbonyl)amino]-1,3-thiazole-5-carboxamide
CID 44143528
6-cyclopropyl-N-(2-pyridin-2-yl-1,3-thiazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
CID 53330053

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide (CID 11045566) is 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide is O=C(Nc1cccnc1C(=O)Nc1nccs1)c1ccccc1.
What is the InChIKey of 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is BOMLSFCDGFXWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O2S/c21-14(11-5-2-1-3-6-11)19-12-7-4-8-17-13(12)15(22)20-16-18-9-10-23-16/h1-10H,(H,19,21)(H,18,20,22).
What are the key properties of 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 324.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 11045566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).