N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide

C17H15N3O2S — CID 124875352

IUPACN-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide
SMILESO=C(N[C@H](Cn1ccccc1=O)c1ccccc1)c1cscn1
InChIInChI=1S/C17H15N3O2S/c21-16-8-4-5-9-20(16)10-14(13-6-2-1-3-7-13)19-17(22)15-11-23-12-18-15/h1-9,11-12,14H,10H2,(H,19,22)/t14-/m1/s1
InChIKeyHOPXUAOTTUCDFO-CQSZACIVSA-N
MW325.39 g/mol
LogP2.48
Rot. Bonds5

About N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide

N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide (PubChem CID 124875352) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide
PubChem CID124875352
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC NameN-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide
SMILESO=C(N[C@H](Cn1ccccc1=O)c1ccccc1)c1cscn1
InChIInChI=1S/C17H15N3O2S/c21-16-8-4-5-9-20(16)10-14(13-6-2-1-3-7-13)19-17(22)15-11-23-12-18-15/h1-9,11-12,14H,10H2,(H,19,22)/t14-/m1/s1
InChIKeyHOPXUAOTTUCDFO-CQSZACIVSA-N
XLogP2.48
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-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-[(1R)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-3-carboxamide
CID 100735320
3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide
CID 124847738
N-(4-hydroxy-4-phenylbutan-2-yl)-1,3-thiazole-4-carboxamide
CID 71852991
N-(2-amino-1-phenyl-2-sulfanylideneethyl)-1,3-thiazole-4-carboxamide
CID 63021833
4-[[2-(2-oxo-1-pyridinyl)-1-phenylethyl]carbamoylamino]butanoic acid
CID 122013493
cis-(1R,3S)-2,2-dimethyl-3-[[2-(2-oxo-1-pyridinyl)-1-phenylethyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 122066942
1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one
CID 36689704
4-phenyl-2-(1,3-thiazole-4-carbonylamino)butanoic acid
CID 114916710
N-phenyl-1,3-thiazole-4-carboxamide
CID 62045972
N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 58337725
1-[2-(2-oxo-1-pyridinyl)-1-phenylethyl]-3-(1-phenyl-3-propan-2-ylpyrazol-5-yl)urea
CID 146132758
1-[2-[[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]amino]-2-phenylethyl]pyridin-2-one
CID 166180141

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide (CID 124875352) is N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide is O=C(N[C@H](Cn1ccccc1=O)c1ccccc1)c1cscn1.
What is the InChIKey of N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide?
The InChIKey is HOPXUAOTTUCDFO-CQSZACIVSA-N. The full InChI is InChI=1S/C17H15N3O2S/c21-16-8-4-5-9-20(16)10-14(13-6-2-1-3-7-13)19-17(22)15-11-23-12-18-15/h1-9,11-12,14H,10H2,(H,19,22)/t14-/m1/s1.
What are the key properties of N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide?
N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide has a molecular weight of 325.39 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 124875352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).