N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide

C14H14FNOS — CID 17069419

IUPACN-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide
SMILESCc1cc(F)ccc1NC(=O)c1csc(C)c1C
InChIInChI=1S/C14H14FNOS/c1-8-6-11(15)4-5-13(8)16-14(17)12-7-18-10(3)9(12)2/h4-7H,1-3H3,(H,16,17)
InChIKeyBKOAHVCHELRPKW-UHFFFAOYSA-N
MW263.34 g/mol
LogP4.06
Rot. Bonds2

About N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide

N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide (PubChem CID 17069419) has the molecular formula C14H14FNOS and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide
PubChem CID17069419
Molecular FormulaC14H14FNOS
Molecular Weight263.34 g/mol
Exact Mass263.08
IUPAC NameN-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide
SMILESCc1cc(F)ccc1NC(=O)c1csc(C)c1C
InChIInChI=1S/C14H14FNOS/c1-8-6-11(15)4-5-13(8)16-14(17)12-7-18-10(3)9(12)2/h4-7H,1-3H3,(H,16,17)
InChIKeyBKOAHVCHELRPKW-UHFFFAOYSA-N
XLogP4.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dimethyl-N-(2-methylphenyl)thiophene-3-carboxamide
CID 84554418
1-N,2-N-bis(4-fluoro-2-methylphenyl)benzene-1,2-dicarboxamide
CID 2811694
N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
CID 7751902
2-chloro-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 6468797
2-bromo-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 9192994
N-(4-fluoro-2-methylphenyl)-2-iodobenzamide
CID 7924517
N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide
CID 2550682
2,3,4,5-tetrafluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 2397902
N-[4-chloro-2-(trifluoromethyl)phenyl]-4,5-dimethylthiophene-3-carboxamide
CID 17172977
2,5-dibromo-N-(4-fluoro-2-methylphenyl)benzamide
CID 114370000
N-(4-fluoro-2-methylphenyl)-1,3-thiazole-5-carboxamide
CID 150699383
2-fluoro-N-(4-fluoro-2-methylphenyl)-5-sulfanylbenzamide
CID 107021333

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide (CID 17069419) is N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide is Cc1cc(F)ccc1NC(=O)c1csc(C)c1C.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide?
The InChIKey is BKOAHVCHELRPKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNOS/c1-8-6-11(15)4-5-13(8)16-14(17)12-7-18-10(3)9(12)2/h4-7H,1-3H3,(H,16,17).
What are the key properties of N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide?
N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 4.06, 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)-4,5-dimethylthiophene-3-carboxamide is sourced from PubChem (CID 17069419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).