N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide

C18H16N2O2S2 — CID 3164945

IUPACN-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccs2)c(NC(=O)Cc2cccs2)c1
InChIInChI=1S/C18H16N2O2S2/c1-12-6-7-14(20-18(22)16-5-3-9-24-16)15(10-12)19-17(21)11-13-4-2-8-23-13/h2-10H,11H2,1H3,(H,19,21)(H,20,22)
InChIKeyWKNJNQBQBBWADF-UHFFFAOYSA-N
MW356.47 g/mol
LogP4.55
Rot. Bonds5

About N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide

N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide (PubChem CID 3164945) has the molecular formula C18H16N2O2S2 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide
PubChem CID3164945
Molecular FormulaC18H16N2O2S2
Molecular Weight356.47 g/mol
Exact Mass356.07
IUPAC NameN-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccs2)c(NC(=O)Cc2cccs2)c1
InChIInChI=1S/C18H16N2O2S2/c1-12-6-7-14(20-18(22)16-5-3-9-24-16)15(10-12)19-17(21)11-13-4-2-8-23-13/h2-10H,11H2,1H3,(H,19,21)(H,20,22)
InChIKeyWKNJNQBQBBWADF-UHFFFAOYSA-N
XLogP4.55
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-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-[4-methyl-2-[(2-methylbenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 9324132
N-(2,5-dimethylphenyl)thiophene-2-carboxamide;ethane
CID 143815290
N-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
CID 113000560
N-(2-acetamidophenyl)-2-thiophen-2-ylacetamide
CID 1363852
N-[2-(2-methoxyethoxy)-4-methylphenyl]thiophene-2-carboxamide
CID 47311026
N-(2,5-dimethylphenyl)-3-[(2-thiophen-2-ylacetyl)hydrazinylidene]butanamide
CID 3567082
2-methyl-N-[2-[(2-thiophen-2-ylacetyl)amino]phenyl]-1H-pyrrole-3-carboxamide
CID 122147242
N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylphenyl]-2-thiophen-2-ylacetamide
CID 7908243
3-(2-methoxy-4-methylphenoxy)-N-[2-[(2-thiophen-2-ylacetyl)amino]phenyl]propanamide
CID 86897699
3-methyl-N-propan-2-yl-4-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 86821541
N-[3-(2-chloro-4-methylanilino)-3-oxopropyl]thiophene-2-carboxamide
CID 17497031
N-[2-[(2,4-dimethylphenyl)sulfonylamino]ethyl]-2-thiophen-2-ylacetamide
CID 108573230

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide (CID 3164945) is N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide is Cc1ccc(NC(=O)c2cccs2)c(NC(=O)Cc2cccs2)c1.
What is the InChIKey of N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide?
The InChIKey is WKNJNQBQBBWADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2S2/c1-12-6-7-14(20-18(22)16-5-3-9-24-16)15(10-12)19-17(21)11-13-4-2-8-23-13/h2-10H,11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide?
N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 4.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 3164945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).