N-(3-acetylphenyl)-2-methylfuran-3-carboxamide

C14H13NO3 — CID 896770

IUPACN-(3-acetylphenyl)-2-methylfuran-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2ccoc2C)c1
InChIInChI=1S/C14H13NO3/c1-9(16)11-4-3-5-12(8-11)15-14(17)13-6-7-18-10(13)2/h3-8H,1-2H3,(H,15,17)
InChIKeyQYYPDECVQIRJMC-UHFFFAOYSA-N
MW243.26 g/mol
LogP3.04
Rot. Bonds3

About N-(3-acetylphenyl)-2-methylfuran-3-carboxamide

N-(3-acetylphenyl)-2-methylfuran-3-carboxamide (PubChem CID 896770) has the molecular formula C14H13NO3 and a molecular weight of 243.26 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-methylfuran-3-carboxamide
PubChem CID896770
Molecular FormulaC14H13NO3
Molecular Weight243.26 g/mol
Exact Mass243.09
IUPAC NameN-(3-acetylphenyl)-2-methylfuran-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2ccoc2C)c1
InChIInChI=1S/C14H13NO3/c1-9(16)11-4-3-5-12(8-11)15-14(17)13-6-7-18-10(13)2/h3-8H,1-2H3,(H,15,17)
InChIKeyQYYPDECVQIRJMC-UHFFFAOYSA-N
XLogP3.04
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-acetylphenyl)-2-methylfuran-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-(3-acetylphenyl)-2,5-dimethylfuran-3-carboxamide
CID 4057606
N-[3-(methoxymethyl)phenyl]-2-methylfuran-3-carboxamide
CID 32638658
N-[3-(cyclopropanecarbonylamino)phenyl]-2-methylfuran-3-carboxamide
CID 38325558
2-[3-[(2-methylfuran-3-carbonyl)amino]phenyl]acetic acid
CID 65345833
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507800
2-methyl-N-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide
CID 17359293
N-[1-[3-(cyclopropanecarbonylamino)phenyl]ethylideneamino]-2-methylfuran-3-carboxamide
CID 4121616
2-methyl-N-[3-[(Z)-C-methyl-N-[(2-methylfuran-3-carbonyl)amino]carbonimidoyl]phenyl]pyrazole-3-carboxamide
CID 6006005
N-[(Z)-1-[3-[(3,4-dimethoxybenzoyl)amino]phenyl]ethylideneamino]-2-methylfuran-3-carboxamide
CID 6005646
N-(3-acetylphenyl)-5-methylfuran-3-carboxamide
CID 114820827
2-bromo-N-(3-methylphenyl)furan-3-carboxamide
CID 106852319
N-(3-acetylphenyl)-3,5-dimethylbenzamide
CID 969392

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-2-methylfuran-3-carboxamide (CID 896770) is N-(3-acetylphenyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-2-methylfuran-3-carboxamide is CC(=O)c1cccc(NC(=O)c2ccoc2C)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-methylfuran-3-carboxamide?
The InChIKey is QYYPDECVQIRJMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO3/c1-9(16)11-4-3-5-12(8-11)15-14(17)13-6-7-18-10(13)2/h3-8H,1-2H3,(H,15,17).
What are the key properties of N-(3-acetylphenyl)-2-methylfuran-3-carboxamide?
N-(3-acetylphenyl)-2-methylfuran-3-carboxamide has a molecular weight of 243.26 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 896770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).