N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide

C15H11N3O3S — CID 16672225

IUPACN-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1ncoc1-c1cccs1
InChIInChI=1S/C15H11N3O3S/c16-14(19)9-4-1-2-5-10(9)18-15(20)12-13(21-8-17-12)11-6-3-7-22-11/h1-8H,(H2,16,19)(H,18,20)
InChIKeyXOTGRNWFBKRNDW-UHFFFAOYSA-N
MW313.34 g/mol
LogP2.75
Rot. Bonds4

About N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide

N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 16672225) has the molecular formula C15H11N3O3S and a molecular weight of 313.34 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
PubChem CID16672225
Molecular FormulaC15H11N3O3S
Molecular Weight313.34 g/mol
Exact Mass313.05
IUPAC NameN-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1ncoc1-c1cccs1
InChIInChI=1S/C15H11N3O3S/c16-14(19)9-4-1-2-5-10(9)18-15(20)12-13(21-8-17-12)11-6-3-7-22-11/h1-8H,(H2,16,19)(H,18,20)
InChIKeyXOTGRNWFBKRNDW-UHFFFAOYSA-N
XLogP2.75
TPSA98.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.34
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-carbamoylphenyl)-5-(2-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 175655098
N-(6-benzamido-3-pyridinyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 75467874
N-(2-aminoethyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide;hydrochloride
CID 19768665
N-(4-propan-2-ylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 20963618
N-(3-fluoro-4-methylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 46347104
N-(3-ethylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 46347103
N-[3-carbamoyl-4-(2-methylpiperidin-1-yl)phenyl]-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 110219072
N-(2-chlorophenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole-4-carboxamide
CID 46347232
2-benzamidobenzamide
CID 702115
N-[4-(1-morpholin-4-ylethyl)phenyl]-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 75463337
4-amino-N-(2-carbamoylphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688483
N-(2-carbamoylphenyl)-1,3-benzoxazole-6-carboxamide
CID 110765134

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide (CID 16672225) is N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide is NC(=O)c1ccccc1NC(=O)c1ncoc1-c1cccs1.
What is the InChIKey of N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is XOTGRNWFBKRNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O3S/c16-14(19)9-4-1-2-5-10(9)18-15(20)12-13(21-8-17-12)11-6-3-7-22-11/h1-8H,(H2,16,19)(H,18,20).
What are the key properties of N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 313.34 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-5-thiophen-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 16672225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).