N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide

C13H12FNOS — CID 2550682

IUPACN-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(F)cc2C)s1
InChIInChI=1S/C13H12FNOS/c1-8-7-10(14)4-5-11(8)15-13(16)12-6-3-9(2)17-12/h3-7H,1-2H3,(H,15,16)
InChIKeyLRDLWHYSAPMWLW-UHFFFAOYSA-N
MW249.31 g/mol
LogP3.76
Rot. Bonds2

About N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide

N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide (PubChem CID 2550682) has the molecular formula C13H12FNOS and a molecular weight of 249.31 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide
PubChem CID2550682
Molecular FormulaC13H12FNOS
Molecular Weight249.31 g/mol
Exact Mass249.06
IUPAC NameN-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(F)cc2C)s1
InChIInChI=1S/C13H12FNOS/c1-8-7-10(14)4-5-11(8)15-13(16)12-6-3-9(2)17-12/h3-7H,1-2H3,(H,15,16)
InChIKeyLRDLWHYSAPMWLW-UHFFFAOYSA-N
XLogP3.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-acetyl-N-(4-fluoro-2-methylphenyl)thiophene-2-carboxamide
CID 18089885
N-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 31458228
N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide
CID 16583786
5-acetamido-N-(4-fluoro-2-methylphenyl)thiophene-2-carboxamide
CID 24608441
N-(2-amino-5-fluorophenyl)-5-methylthiophene-2-carboxamide
CID 55169355
N-(4-fluoro-2-methylphenyl)-1,3-thiazole-5-carboxamide
CID 150699383
5-methyl-N-[2-methyl-4-(propan-2-ylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 86821543
N-(4-fluoro-2-methylphenyl)-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide
CID 27286968
1-N,2-N-bis(4-fluoro-2-methylphenyl)benzene-1,2-dicarboxamide
CID 2811694
N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide
CID 17069419
N-(4-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 103891547
N-(4-fluoro-2-methylphenyl)-4-iodobenzamide
CID 7980558

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide (CID 2550682) is N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)Nc2ccc(F)cc2C)s1.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide?
The InChIKey is LRDLWHYSAPMWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNOS/c1-8-7-10(14)4-5-11(8)15-13(16)12-6-3-9(2)17-12/h3-7H,1-2H3,(H,15,16).
What are the key properties of N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide?
N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 2550682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).