5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide

C16H14N2O3S — CID 59370610

IUPAC5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide
SMILESO=C(NCCc1cccs1)n1oc(=O)cc1-c1ccccc1
InChIInChI=1S/C16H14N2O3S/c19-15-11-14(12-5-2-1-3-6-12)18(21-15)16(20)17-9-8-13-7-4-10-22-13/h1-7,10-11H,8-9H2,(H,17,20)
InChIKeyJOTOEIKDQSAEEZ-UHFFFAOYSA-N
MW314.37 g/mol
LogP2.97
Rot. Bonds4

About 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide

5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide (PubChem CID 59370610) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide.

Molecular Properties

Compound Name5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide
PubChem CID59370610
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC Name5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide
SMILESO=C(NCCc1cccs1)n1oc(=O)cc1-c1ccccc1
InChIInChI=1S/C16H14N2O3S/c19-15-11-14(12-5-2-1-3-6-12)18(21-15)16(20)17-9-8-13-7-4-10-22-13/h1-7,10-11H,8-9H2,(H,17,20)
InChIKeyJOTOEIKDQSAEEZ-UHFFFAOYSA-N
XLogP2.97
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-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

2-(1,5-diphenylimidazol-2-yl)sulfanyl-N-(2-thiophen-2-ylethyl)acetamide
CID 18208318
2-(5-phenyltetrazol-2-yl)-N-(2-thiophen-2-ylethyl)propanamide
CID 86908769
2-hydroxy-N-(2-thiophen-2-ylethyl)acetamide
CID 13454159
4-oxo-4-(4-phenylphenyl)-N-(2-thiophen-2-ylethyl)butanamide
CID 17449159
2-oxo-N-(4-thiophen-2-ylbutyl)-1,3-benzoxazole-3-carboxamide
CID 118513796
9-oxo-N-(2-thiophen-2-ylethyl)fluorene-2-carboxamide
CID 16612942
N'-(2-thiophen-2-ylethyl)oxamide
CID 115192053
2-(3-phenylindazol-1-yl)-N-(2-thiophen-2-ylethyl)propanamide
CID 20877636
2-[4-(2-thiophen-2-ylethylcarbamoyl)thiomorpholin-3-yl]acetic acid
CID 66443935
2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-(2-thiophen-2-ylethyl)acetamide
CID 8955996
N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]benzamide
CID 27770371
2-amino-2-phenyl-N-(2-thiophen-2-ylethyl)acetamide
CID 24704735

Frequently Asked Questions

What is the IUPAC name of 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide?
The IUPAC name of 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide (CID 59370610) is 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide.
What is the SMILES notation for 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide?
The canonical SMILES for 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide is O=C(NCCc1cccs1)n1oc(=O)cc1-c1ccccc1.
What is the InChIKey of 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide?
The InChIKey is JOTOEIKDQSAEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c19-15-11-14(12-5-2-1-3-6-12)18(21-15)16(20)17-9-8-13-7-4-10-22-13/h1-7,10-11H,8-9H2,(H,17,20).
What are the key properties of 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide?
5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide has a molecular weight of 314.37 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-oxazole-2-carboxamide is sourced from PubChem (CID 59370610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).