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

C19H18N4O3S — CID 16881515

IUPAC2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide
SMILESO=C(Cc1csc(NC(=O)c2ccc[nH]c2=O)n1)NCCc1ccccc1
InChIInChI=1S/C19H18N4O3S/c24-16(20-10-8-13-5-2-1-3-6-13)11-14-12-27-19(22-14)23-18(26)15-7-4-9-21-17(15)25/h1-7,9,12H,8,10-11H2,(H,20,24)(H,21,25)(H,22,23,26)
InChIKeyLJBWJKOCOLJNGM-UHFFFAOYSA-N
MW382.45 g/mol
LogP1.99
Rot. Bonds7

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

2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide (PubChem CID 16881515) has the molecular formula C19H18N4O3S and a molecular weight of 382.45 g/mol. Its IUPAC name is 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide
PubChem CID16881515
Molecular FormulaC19H18N4O3S
Molecular Weight382.45 g/mol
Exact Mass382.11
IUPAC Name2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide
SMILESO=C(Cc1csc(NC(=O)c2ccc[nH]c2=O)n1)NCCc1ccccc1
InChIInChI=1S/C19H18N4O3S/c24-16(20-10-8-13-5-2-1-3-6-13)11-14-12-27-19(22-14)23-18(26)15-7-4-9-21-17(15)25/h1-7,9,12H,8,10-11H2,(H,20,24)(H,21,25)(H,22,23,26)
InChIKeyLJBWJKOCOLJNGM-UHFFFAOYSA-N
XLogP1.99
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.45
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide with MolForge

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Related Compounds

4-[2-[(2-oxo-1H-pyridine-3-carbonyl)amino]-1,3-thiazol-4-yl]butanoic acid
CID 80655774
2-[2-[(4-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(2-phenylethyl)acetamide
CID 18567492
N-[4-[3-(2,5-dimethylanilino)-3-oxopropyl]-1,3-thiazol-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 27378479
N-[4-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]-1,3-thiazol-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 16881497
2-(2-amino-1,3-thiazol-4-yl)-N-(2-phenylethyl)acetamide
CID 3561835
(E)-N-[4-[2-oxo-2-(3-phenylpropylamino)ethyl]-1,3-thiazol-2-yl]-3-phenylprop-2-enamide
CID 41229665
N-[4-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-1,3-thiazol-2-yl]-2-methylfuran-3-carboxamide
CID 46488883
2-oxo-N-[4-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide
CID 16881577
N-[4-[3-(3-chloro-2-methylanilino)-3-oxopropyl]-1,3-thiazol-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 27378481
N-[4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1,3-thiazol-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 16881496
N-[4-[2-oxo-2-[2-[4-(trifluoromethyl)phenyl]ethylamino]ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 26927396
2-[(2-phenylacetyl)amino]-N-(2-phenylethyl)-1,3-thiazole-4-carboxamide
CID 84555769

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide?
The IUPAC name of 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide (CID 16881515) is 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide is O=C(Cc1csc(NC(=O)c2ccc[nH]c2=O)n1)NCCc1ccccc1.
What is the InChIKey of 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide?
The InChIKey is LJBWJKOCOLJNGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3S/c24-16(20-10-8-13-5-2-1-3-6-13)11-14-12-27-19(22-14)23-18(26)15-7-4-9-21-17(15)25/h1-7,9,12H,8,10-11H2,(H,20,24)(H,21,25)(H,22,23,26).
What are the key properties of 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide?
2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide has a molecular weight of 382.45 g/mol, XLogP of 1.99, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[4-[2-oxo-2-(2-phenylethylamino)ethyl]-1,3-thiazol-2-yl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 16881515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).