4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide

C12H12N2O2S — CID 146179498

IUPAC4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
SMILESCc1cc(NC(=O)c2cc(C3CC3)cs2)no1
InChIInChI=1S/C12H12N2O2S/c1-7-4-11(14-16-7)13-12(15)10-5-9(6-17-10)8-2-3-8/h4-6,8H,2-3H2,1H3,(H,13,14,15)
InChIKeyJNSYWXQQPAIXMN-UHFFFAOYSA-N
MW248.31 g/mol
LogP3.17
Rot. Bonds3

About 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide

4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide (PubChem CID 146179498) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
PubChem CID146179498
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Name4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
SMILESCc1cc(NC(=O)c2cc(C3CC3)cs2)no1
InChIInChI=1S/C12H12N2O2S/c1-7-4-11(14-16-7)13-12(15)10-5-9(6-17-10)8-2-3-8/h4-6,8H,2-3H2,1H3,(H,13,14,15)
InChIKeyJNSYWXQQPAIXMN-UHFFFAOYSA-N
XLogP3.17
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 110865517
N-(5-methyl-1,2-oxazol-3-yl)-4-[2-(oxan-4-ylmethylamino)cyclopropyl]thiophene-2-carboxamide
CID 118432924
4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 27262017
4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 27261158
N-(5-methyl-1,2-oxazol-3-yl)-4-thiomorpholin-4-ylsulfonylthiophene-2-carboxamide
CID 6504167
4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 6503197
N-(5-methyl-1,2-oxazol-3-yl)-4-[(4-methyl-2-pyridinyl)sulfamoyl]thiophene-2-carboxamide
CID 27261690
4-[(4-methoxyphenyl)sulfamoyl]-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 6504134
N-(5-methyl-1,2-oxazol-3-yl)-4-[methyl(2-phenylethyl)sulfamoyl]thiophene-2-carboxamide
CID 6503614
1-methyl-3-(5-methyl-1,2-oxazol-3-yl)-1-(4-phenylcyclohexyl)urea
CID 51122102
4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 46292695
N-(5-methyl-1,2-oxazol-3-yl)oxane-4-carboxamide
CID 110690048

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
The IUPAC name of 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide (CID 146179498) is 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide is Cc1cc(NC(=O)c2cc(C3CC3)cs2)no1.
What is the InChIKey of 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
The InChIKey is JNSYWXQQPAIXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-7-4-11(14-16-7)13-12(15)10-5-9(6-17-10)8-2-3-8/h4-6,8H,2-3H2,1H3,(H,13,14,15).
What are the key properties of 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide has a molecular weight of 248.31 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 146179498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).