2-acetamido-N-phenylthiophene-3-carboxamide

C13H12N2O2S — CID 901593

IUPAC2-acetamido-N-phenylthiophene-3-carboxamide
SMILESCC(=O)Nc1sccc1C(=O)Nc1ccccc1
InChIInChI=1S/C13H12N2O2S/c1-9(16)14-13-11(7-8-18-13)12(17)15-10-5-3-2-4-6-10/h2-8H,1H3,(H,14,16)(H,15,17)
InChIKeyQKPYUSCLHDJKQS-UHFFFAOYSA-N
MW260.32 g/mol
LogP2.96
Rot. Bonds3

About 2-acetamido-N-phenylthiophene-3-carboxamide

2-acetamido-N-phenylthiophene-3-carboxamide (PubChem CID 901593) has the molecular formula C13H12N2O2S and a molecular weight of 260.32 g/mol. Its IUPAC name is 2-acetamido-N-phenylthiophene-3-carboxamide.

Molecular Properties

Compound Name2-acetamido-N-phenylthiophene-3-carboxamide
PubChem CID901593
Molecular FormulaC13H12N2O2S
Molecular Weight260.32 g/mol
Exact Mass260.06
IUPAC Name2-acetamido-N-phenylthiophene-3-carboxamide
SMILESCC(=O)Nc1sccc1C(=O)Nc1ccccc1
InChIInChI=1S/C13H12N2O2S/c1-9(16)14-13-11(7-8-18-13)12(17)15-10-5-3-2-4-6-10/h2-8H,1H3,(H,14,16)(H,15,17)
InChIKeyQKPYUSCLHDJKQS-UHFFFAOYSA-N
XLogP2.96
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-acetamido-N-phenylthiophene-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

2-(phenylcarbamoyl)thiophene-3-carboxylic acid
CID 15022369
2-[(3-acetamidobenzoyl)amino]thiophene-3-carboxylic acid
CID 43171537
N-[3-(2,2-dimethylpropanoyl)thiophen-2-yl]acetamide
CID 71999399
cobalt;N-phenylacetamide
CID 158689050
2-benzamidothiophene-3-carboxylic acid
CID 16639461
cis-(1S,2R)-2-[[3-[(3-acetylphenyl)carbamoyl]thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid
CID 27524898
ethyl 2-[[2-[2-(phenylcarbamoyl)phenoxy]acetyl]amino]thiophene-3-carboxylate
CID 41428664
6-[[3-[(3-acetylphenyl)carbamoyl]thiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 17377605
4-acetyl-N-phenylnaphthalene-1-carboxamide
CID 70204412
4,5-dimethyl-N-phenylthiophene-3-carboxamide
CID 3475307
(1S,6S)-6-[[3-[(4-chlorophenyl)carbamoyl]thiophen-2-yl]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 27527077
ethane;2-hydroxy-N-phenylbenzamide
CID 54170056

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-phenylthiophene-3-carboxamide?
The IUPAC name of 2-acetamido-N-phenylthiophene-3-carboxamide (CID 901593) is 2-acetamido-N-phenylthiophene-3-carboxamide.
What is the SMILES notation for 2-acetamido-N-phenylthiophene-3-carboxamide?
The canonical SMILES for 2-acetamido-N-phenylthiophene-3-carboxamide is CC(=O)Nc1sccc1C(=O)Nc1ccccc1.
What is the InChIKey of 2-acetamido-N-phenylthiophene-3-carboxamide?
The InChIKey is QKPYUSCLHDJKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2S/c1-9(16)14-13-11(7-8-18-13)12(17)15-10-5-3-2-4-6-10/h2-8H,1H3,(H,14,16)(H,15,17).
What are the key properties of 2-acetamido-N-phenylthiophene-3-carboxamide?
2-acetamido-N-phenylthiophene-3-carboxamide has a molecular weight of 260.32 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-phenylthiophene-3-carboxamide is sourced from PubChem (CID 901593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).