N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide

C20H18N2O3S — CID 55834572

IUPACN-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide
SMILESCOc1cc(-c2ccccc2)sc1C(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C20H18N2O3S/c1-13(23)21-15-9-6-10-16(11-15)22-20(24)19-17(25-2)12-18(26-19)14-7-4-3-5-8-14/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyKXJUAYZBUIAZDX-UHFFFAOYSA-N
MW366.44 g/mol
LogP4.63
Rot. Bonds5

About N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide

N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide (PubChem CID 55834572) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide
PubChem CID55834572
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC NameN-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide
SMILESCOc1cc(-c2ccccc2)sc1C(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C20H18N2O3S/c1-13(23)21-15-9-6-10-16(11-15)22-20(24)19-17(25-2)12-18(26-19)14-7-4-3-5-8-14/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyKXJUAYZBUIAZDX-UHFFFAOYSA-N
XLogP4.63
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-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

3-ethoxy-N-[3-[(2-methoxyacetyl)amino]phenyl]-5-phenylthiophene-2-carboxamide
CID 55793294
3-methoxy-N-(5-methyl-1,3-thiazol-2-yl)-5-phenylthiophene-2-carboxamide
CID 52671085
2-acetamido-N-(3-methoxyphenyl)-5-phenylthiophene-3-carboxamide
CID 7673753
N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide
CID 52667720
3-hydroxy-5-(4-methoxyphenyl)-N-phenylthiophene-2-carboxamide
CID 155806102
N-(3-acetamidophenyl)-2,4-diphenyl-1,3-thiazole-5-carboxamide
CID 9074270
3-methoxy-N-[2-(methylamino)propyl]-5-phenylthiophene-2-carboxamide
CID 120831086
N-[1-[4-(carbamoylamino)phenyl]ethyl]-3-methoxy-5-phenylthiophene-2-carboxamide
CID 55961939
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methoxy-5-phenylthiophene-2-carboxamide
CID 119457762
phenyl 3-methoxy-5-phenylthiophene-2-carboxylate
CID 139631603
N-(2-hydroxy-3,3-dimethylbutyl)-3-methoxy-5-phenylthiophene-2-carboxamide
CID 71848991
3-methoxy-5-phenyl-N-pyrrolidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 119452328

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide (CID 55834572) is N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide is COc1cc(-c2ccccc2)sc1C(=O)Nc1cccc(NC(C)=O)c1.
What is the InChIKey of N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide?
The InChIKey is KXJUAYZBUIAZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3S/c1-13(23)21-15-9-6-10-16(11-15)22-20(24)19-17(25-2)12-18(26-19)14-7-4-3-5-8-14/h3-12H,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide?
N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide has a molecular weight of 366.44 g/mol, XLogP of 4.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide is sourced from PubChem (CID 55834572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).