N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide

C20H18N2O3 — CID 2979994

IUPACN-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccco2)cc1)c1ccccc1
InChIInChI=1S/C20H18N2O3/c1-2-22(17-7-4-3-5-8-17)20(24)15-10-12-16(13-11-15)21-19(23)18-9-6-14-25-18/h3-14H,2H2,1H3,(H,21,23)
InChIKeySSYUBVPLRSGPFZ-UHFFFAOYSA-N
MW334.38 g/mol
LogP4.20
Rot. Bonds5

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

N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 2979994) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID2979994
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC NameN-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccco2)cc1)c1ccccc1
InChIInChI=1S/C20H18N2O3/c1-2-22(17-7-4-3-5-8-17)20(24)15-10-12-16(13-11-15)21-19(23)18-9-6-14-25-18/h3-14H,2H2,1H3,(H,21,23)
InChIKeySSYUBVPLRSGPFZ-UHFFFAOYSA-N
XLogP4.20
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide (CID 2979994) is N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide is CCN(C(=O)c1ccc(NC(=O)c2ccco2)cc1)c1ccccc1.
What is the InChIKey of N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is SSYUBVPLRSGPFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-2-22(17-7-4-3-5-8-17)20(24)15-10-12-16(13-11-15)21-19(23)18-9-6-14-25-18/h3-14H,2H2,1H3,(H,21,23).
What are the key properties of N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 2979994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).