N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide

C12H10FNO2S — CID 79808290

IUPACN-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide
SMILESCc1cscc1C(=O)Nc1ccc(O)cc1F
InChIInChI=1S/C12H10FNO2S/c1-7-5-17-6-9(7)12(16)14-11-3-2-8(15)4-10(11)13/h2-6,15H,1H3,(H,14,16)
InChIKeyDVJCONVZXSUEAR-UHFFFAOYSA-N
MW251.28 g/mol
LogP3.15
Rot. Bonds2

About N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide

N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide (PubChem CID 79808290) has the molecular formula C12H10FNO2S and a molecular weight of 251.28 g/mol. Its IUPAC name is N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide
PubChem CID79808290
Molecular FormulaC12H10FNO2S
Molecular Weight251.28 g/mol
Exact Mass251.04
IUPAC NameN-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide
SMILESCc1cscc1C(=O)Nc1ccc(O)cc1F
InChIInChI=1S/C12H10FNO2S/c1-7-5-17-6-9(7)12(16)14-11-3-2-8(15)4-10(11)13/h2-6,15H,1H3,(H,14,16)
InChIKeyDVJCONVZXSUEAR-UHFFFAOYSA-N
XLogP3.15
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,4-difluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941207
4-hydroxy-2-methyl-N-(2,4,5-trifluorophenyl)benzamide
CID 103863779
N-(2-aminophenyl)-4-methylthiophene-3-carboxamide
CID 79802569
N-(2-fluoro-4-hydroxyphenyl)-3-methyl-2-nitrobenzamide
CID 64793485
2-fluoro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 1234575
5-chloro-N-(2-fluoro-4-hydroxyphenyl)-2-hydroxybenzamide
CID 64793866
5-bromo-2-fluoro-N-(2-fluoro-4-hydroxyphenyl)benzamide
CID 64793128
N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide
CID 107676274
N-(2-fluoro-4-hydroxyphenyl)-2-hydroxy-5-methoxybenzamide
CID 64794044
4-[(2-fluoro-4-hydroxybenzoyl)amino]-3-methylbenzoic acid
CID 107674680
N-(2-fluoro-4-hydroxyphenyl)naphthalene-1-carboxamide
CID 64795170
N-(2-fluoro-4-hydroxyphenyl)-3-methoxy-4-methylbenzamide
CID 64795336

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide?
The IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide (CID 79808290) is N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide.
What is the SMILES notation for N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide?
The canonical SMILES for N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide is Cc1cscc1C(=O)Nc1ccc(O)cc1F.
What is the InChIKey of N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide?
The InChIKey is DVJCONVZXSUEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO2S/c1-7-5-17-6-9(7)12(16)14-11-3-2-8(15)4-10(11)13/h2-6,15H,1H3,(H,14,16).
What are the key properties of N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide?
N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide has a molecular weight of 251.28 g/mol, XLogP of 3.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-hydroxyphenyl)-4-methylthiophene-3-carboxamide is sourced from PubChem (CID 79808290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).