N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide

C19H16N2O3 — CID 977240

IUPACN-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(NCc1ccccc1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C19H16N2O3/c22-18(20-13-14-5-2-1-3-6-14)15-8-10-16(11-9-15)21-19(23)17-7-4-12-24-17/h1-12H,13H2,(H,20,22)(H,21,23)
InChIKeyLZYCGGCRKPVHCE-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.46
Rot. Bonds5

About N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide

N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide (PubChem CID 977240) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide
PubChem CID977240
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(NCc1ccccc1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C19H16N2O3/c22-18(20-13-14-5-2-1-3-6-14)15-8-10-16(11-9-15)21-19(23)17-7-4-12-24-17/h1-12H,13H2,(H,20,22)(H,21,23)
InChIKeyLZYCGGCRKPVHCE-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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide (CID 977240) is N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide is O=C(NCc1ccccc1)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
The InChIKey is LZYCGGCRKPVHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c22-18(20-13-14-5-2-1-3-6-14)15-8-10-16(11-9-15)21-19(23)17-7-4-12-24-17/h1-12H,13H2,(H,20,22)(H,21,23).
What are the key properties of N-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide?
N-[4-(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-[4-(benzylcarbamoyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 977240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).