N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide

C21H19NO2 — CID 134918144

IUPACN-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide
SMILESCc1ccc(N(C/C=C/c2ccco2)C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19NO2/c1-17-11-13-19(14-12-17)22(15-5-9-20-10-6-16-24-20)21(23)18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/b9-5+
InChIKeyCYCSMMGCONTUOE-WEVVVXLNSA-N
MW317.39 g/mol
LogP4.95
Rot. Bonds5

About N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide

N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide (PubChem CID 134918144) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound NameN-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide
PubChem CID134918144
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC NameN-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide
SMILESCc1ccc(N(C/C=C/c2ccco2)C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19NO2/c1-17-11-13-19(14-12-17)22(15-5-9-20-10-6-16-24-20)21(23)18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/b9-5+
InChIKeyCYCSMMGCONTUOE-WEVVVXLNSA-N
XLogP4.95
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide 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-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide?
The IUPAC name of N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide (CID 134918144) is N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide.
What is the SMILES notation for N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide?
The canonical SMILES for N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide is Cc1ccc(N(C/C=C/c2ccco2)C(=O)c2ccccc2)cc1.
What is the InChIKey of N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide?
The InChIKey is CYCSMMGCONTUOE-WEVVVXLNSA-N. The full InChI is InChI=1S/C21H19NO2/c1-17-11-13-19(14-12-17)22(15-5-9-20-10-6-16-24-20)21(23)18-7-3-2-4-8-18/h2-14,16H,15H2,1H3/b9-5+.
What are the key properties of N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide?
N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide has a molecular weight of 317.39 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-3-(furan-2-yl)prop-2-enyl]-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 134918144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).