N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide

C26H22N2O4 — CID 27038930

IUPACN-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1Cc1ccccc1
InChIInChI=1S/C26H22N2O4/c1-31-23-14-13-22(17-20(23)16-18-6-3-2-4-7-18)28-25(29)19-9-11-21(12-10-19)27-26(30)24-8-5-15-32-24/h2-15,17H,16H2,1H3,(H,27,30)(H,28,29)
InChIKeySKMUFXLATFRWTH-UHFFFAOYSA-N
MW426.47 g/mol
LogP5.38
Rot. Bonds7

About N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide

N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 27038930) has the molecular formula C26H22N2O4 and a molecular weight of 426.47 g/mol. Its IUPAC name is N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID27038930
Molecular FormulaC26H22N2O4
Molecular Weight426.47 g/mol
Exact Mass426.16
IUPAC NameN-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1Cc1ccccc1
InChIInChI=1S/C26H22N2O4/c1-31-23-14-13-22(17-20(23)16-18-6-3-2-4-7-18)28-25(29)19-9-11-21(12-10-19)27-26(30)24-8-5-15-32-24/h2-15,17H,16H2,1H3,(H,27,30)(H,28,29)
InChIKeySKMUFXLATFRWTH-UHFFFAOYSA-N
XLogP5.38
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.47
LogP ≤ 55.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]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

Related Compounds

N-(3-ethyl-4-methoxyphenyl)furan-2-carboxamide
CID 110777193
N-(3-benzyl-4-methoxyphenyl)-5-bromofuran-2-carboxamide
CID 42372295
N-[4-methoxy-3-[(4-methylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 655668
N-(3-benzyl-4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 27038842
N-[4-[(3-methoxy-4-prop-2-enoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 42014838
N-(3-hydroxy-4-methoxyphenyl)furan-2-carboxamide
CID 56690057
N-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 9270038
4-amino-N-(3-benzyl-4-methoxyphenyl)-3-nitrobenzamide
CID 42372191
N-(3-benzyl-4-methoxyphenyl)-5-sulfamoylthiophene-3-carboxamide
CID 134045577
N-(4-methoxy-3-propan-2-ylphenyl)furan-2-carboxamide
CID 110776754
N-[4-[(2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 872367
(2-methoxy-4-methylphenyl) 4-(furan-2-carbonylamino)benzoate
CID 51205552

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide (CID 27038930) is N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide is COc1ccc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1Cc1ccccc1.
What is the InChIKey of N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is SKMUFXLATFRWTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O4/c1-31-23-14-13-22(17-20(23)16-18-6-3-2-4-7-18)28-25(29)19-9-11-21(12-10-19)27-26(30)24-8-5-15-32-24/h2-15,17H,16H2,1H3,(H,27,30)(H,28,29).
What are the key properties of N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 426.47 g/mol, XLogP of 5.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-benzyl-4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 27038930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).