5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide

C13H14N2O2S — CID 71690295

IUPAC5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide
SMILESCC(C)NC(=O)c1ccc(-c2ccc(=O)[nH]c2)s1
InChIInChI=1S/C13H14N2O2S/c1-8(2)15-13(17)11-5-4-10(18-11)9-3-6-12(16)14-7-9/h3-8H,1-2H3,(H,14,16)(H,15,17)
InChIKeyGBGWPTHECKDJST-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.24
Rot. Bonds3

About 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide

5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide (PubChem CID 71690295) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide
PubChem CID71690295
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide
SMILESCC(C)NC(=O)c1ccc(-c2ccc(=O)[nH]c2)s1
InChIInChI=1S/C13H14N2O2S/c1-8(2)15-13(17)11-5-4-10(18-11)9-3-6-12(16)14-7-9/h3-8H,1-2H3,(H,14,16)(H,15,17)
InChIKeyGBGWPTHECKDJST-UHFFFAOYSA-N
XLogP2.24
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-fluorophenyl)-N-propan-2-ylthiophene-2-carboxamide
CID 35807263
5-(6-oxo-1H-pyridin-3-yl)thiophene-2-carboxylate
CID 2052637
5-(6-amino-3-pyridinyl)-N-propan-2-ylthiophene-2-carboxamide
CID 151586572
N-[(5-methylfuran-2-yl)methyl]-5-(6-oxo-1H-pyridin-3-yl)thiophene-2-carboxamide
CID 71691389
N-[(1S)-1-cyclopropylethyl]-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 30796420
5-(3-piperazin-1-ylphenyl)-N-propan-2-ylthiophene-2-carboxamide
CID 72842682
5-(4-chlorophenyl)-N-(1-methoxypropan-2-yl)thiophene-2-carboxamide
CID 24658856
N-propan-2-yl-2-sulfanylidene-3H-1,3-thiazole-5-carboxamide
CID 70038292
5-(3,4-difluorophenyl)-N-[(2R)-3,3-dimethylbutan-2-yl]thiophene-2-carboxamide
CID 92758248
5-(4-fluorophenyl)-N'-(2-methylpropanoyl)thiophene-2-carbohydrazide
CID 24554163
3-[[5-[4-(difluoromethoxy)phenyl]thiophene-2-carbonyl]amino]butanoic acid
CID 119221199
N-hydroxy-5-(4-methoxyphenyl)thiophene-2-carboxamide
CID 58657217

Frequently Asked Questions

What is the IUPAC name of 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide?
The IUPAC name of 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide (CID 71690295) is 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide.
What is the SMILES notation for 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide?
The canonical SMILES for 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide is CC(C)NC(=O)c1ccc(-c2ccc(=O)[nH]c2)s1.
What is the InChIKey of 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide?
The InChIKey is GBGWPTHECKDJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-8(2)15-13(17)11-5-4-10(18-11)9-3-6-12(16)14-7-9/h3-8H,1-2H3,(H,14,16)(H,15,17).
What are the key properties of 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide?
5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide has a molecular weight of 262.33 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-oxo-1H-pyridin-3-yl)-N-propan-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 71690295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).