6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide

C16H14N4O2S — CID 110625021

IUPAC6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide
SMILESO=C(NCCc1csc(-c2ccncc2)n1)c1ccc(=O)[nH]c1
InChIInChI=1S/C16H14N4O2S/c21-14-2-1-12(9-19-14)15(22)18-8-5-13-10-23-16(20-13)11-3-6-17-7-4-11/h1-4,6-7,9-10H,5,8H2,(H,18,22)(H,19,21)
InChIKeyONRZWQIWSGEIGY-UHFFFAOYSA-N
MW326.38 g/mol
LogP1.87
Rot. Bonds5

About 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide

6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide (PubChem CID 110625021) has the molecular formula C16H14N4O2S and a molecular weight of 326.38 g/mol. Its IUPAC name is 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide
PubChem CID110625021
Molecular FormulaC16H14N4O2S
Molecular Weight326.38 g/mol
Exact Mass326.08
IUPAC Name6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide
SMILESO=C(NCCc1csc(-c2ccncc2)n1)c1ccc(=O)[nH]c1
InChIInChI=1S/C16H14N4O2S/c21-14-2-1-12(9-19-14)15(22)18-8-5-13-10-23-16(20-13)11-3-6-17-7-4-11/h1-4,6-7,9-10H,5,8H2,(H,18,22)(H,19,21)
InChIKeyONRZWQIWSGEIGY-UHFFFAOYSA-N
XLogP1.87
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-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

6-oxo-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide
CID 110624969
N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1,3-benzodioxole-5-carboxamide
CID 110285051
4-methyl-N-[2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl]benzamide
CID 7287432
N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-4,5,6,7-tetrahydro-2,1-benzoxazole-3-carboxamide
CID 122131376
3-phenyl-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]propanamide
CID 112500664
4-(dimethylamino)-N-[2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl]benzamide
CID 47093407
N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 91787820
N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 24552868
4-bromo-N-[2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl]benzamide
CID 7287449
3,4-dimethyl-N-[2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl]benzamide
CID 7287435
N-[2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl]-4-(trifluoromethyl)benzamide
CID 7518387
6-oxo-N-(2-phenylethyl)-1H-pyridine-3-carboxamide
CID 2090847

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide (CID 110625021) is 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide is O=C(NCCc1csc(-c2ccncc2)n1)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide?
The InChIKey is ONRZWQIWSGEIGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2S/c21-14-2-1-12(9-19-14)15(22)18-8-5-13-10-23-16(20-13)11-3-6-17-7-4-11/h1-4,6-7,9-10H,5,8H2,(H,18,22)(H,19,21).
What are the key properties of 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide?
6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide has a molecular weight of 326.38 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110625021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).