N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide

C19H16N2O3 — CID 1331247

IUPACN-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(NCc1ccccc1)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C19H16N2O3/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-12H,13H2,(H,20,22)(H,21,23)
InChIKeyHSJBTGGMOMLRGB-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.46
Rot. Bonds5

About N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide

N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide (PubChem CID 1331247) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide
PubChem CID1331247
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(NCc1ccccc1)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C19H16N2O3/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-12H,13H2,(H,20,22)(H,21,23)
InChIKeyHSJBTGGMOMLRGB-UHFFFAOYSA-N
XLogP3.46
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(benzylcarbamoyl)phenyl]furan-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

Frequently Asked Questions

What is the IUPAC name of N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide (CID 1331247) is N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide is O=C(NCc1ccccc1)c1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
The InChIKey is HSJBTGGMOMLRGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-12H,13H2,(H,20,22)(H,21,23).
What are the key properties of N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 3.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 1331247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).