N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide

C12H9F2NOS — CID 16583786

IUPACN-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2cc(F)ccc2F)s1
InChIInChI=1S/C12H9F2NOS/c1-7-2-5-11(17-7)12(16)15-10-6-8(13)3-4-9(10)14/h2-6H,1H3,(H,15,16)
InChIKeyUYJFDGINAISBII-UHFFFAOYSA-N
MW253.27 g/mol
LogP3.59
Rot. Bonds2

About N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide

N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide (PubChem CID 16583786) has the molecular formula C12H9F2NOS and a molecular weight of 253.27 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide
PubChem CID16583786
Molecular FormulaC12H9F2NOS
Molecular Weight253.27 g/mol
Exact Mass253.04
IUPAC NameN-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)Nc2cc(F)ccc2F)s1
InChIInChI=1S/C12H9F2NOS/c1-7-2-5-11(17-7)12(16)15-10-6-8(13)3-4-9(10)14/h2-6H,1H3,(H,15,16)
InChIKeyUYJFDGINAISBII-UHFFFAOYSA-N
XLogP3.59
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-5-fluorophenyl)-5-methylthiophene-2-carboxamide
CID 55169355
N-(4-fluoro-2-methylphenyl)-5-methylthiophene-2-carboxamide
CID 2550682
N-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 31458228
5-acetyl-N-(4-fluoro-2-methylphenyl)thiophene-2-carboxamide
CID 18089885
N-(3-amino-5-fluorophenyl)-5-methylthiophene-2-carboxamide
CID 107333812
2,5-dichloro-N-(2,5-difluorophenyl)thiophene-3-carboxamide
CID 51191647
5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide
CID 61076675
5-acetamido-N-(4-fluoro-2-methylphenyl)thiophene-2-carboxamide
CID 24608441
N-(2,5-difluorophenyl)-3-methyl-6-(5-methylthiophen-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 24603273
4-chloro-N-(2,5-difluorophenyl)benzamide
CID 2969912
N-(2,3-dimethylphenyl)-5-methylthiophene-2-carboxamide
CID 7733041
N-[(2S)-2-(2,4-difluorophenyl)-2-hydroxyethyl]-5-methylthiophene-2-carboxamide
CID 38524814

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide?
The IUPAC name of N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide (CID 16583786) is N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)Nc2cc(F)ccc2F)s1.
What is the InChIKey of N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide?
The InChIKey is UYJFDGINAISBII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NOS/c1-7-2-5-11(17-7)12(16)15-10-6-8(13)3-4-9(10)14/h2-6H,1H3,(H,15,16).
What are the key properties of N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide?
N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide has a molecular weight of 253.27 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 16583786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).