N-(1,2-diphenylethenyl)-N-methylaniline

C21H19N — CID 76766210

IUPACN-(1,2-diphenylethenyl)-N-methylaniline
SMILESCN(C(=Cc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H19N/c1-22(20-15-9-4-10-16-20)21(19-13-7-3-8-14-19)17-18-11-5-2-6-12-18/h2-17H,1H3
InChIKeyAFUVLFZTJGXFPW-UHFFFAOYSA-N
MW285.39 g/mol
LogP5.32
Rot. Bonds4

About N-(1,2-diphenylethenyl)-N-methylaniline

N-(1,2-diphenylethenyl)-N-methylaniline (PubChem CID 76766210) has the molecular formula C21H19N and a molecular weight of 285.39 g/mol. Its IUPAC name is N-(1,2-diphenylethenyl)-N-methylaniline.

Molecular Properties

Compound NameN-(1,2-diphenylethenyl)-N-methylaniline
PubChem CID76766210
Molecular FormulaC21H19N
Molecular Weight285.39 g/mol
Exact Mass285.15
IUPAC NameN-(1,2-diphenylethenyl)-N-methylaniline
SMILESCN(C(=Cc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H19N/c1-22(20-15-9-4-10-16-20)21(19-13-7-3-8-14-19)17-18-11-5-2-6-12-18/h2-17H,1H3
InChIKeyAFUVLFZTJGXFPW-UHFFFAOYSA-N
XLogP5.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.39
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze N-(1,2-diphenylethenyl)-N-methylaniline 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-[(E)-1-bromo-2-phenylethenyl]-N-methylaniline
CID 132574218
N-[(Z)-1,2-diphenylethenyl]-N-phenylaniline
CID 67853928
N-[(Z)-1,2-diphenylethenyl]-N-methylacetamide
CID 134977102
N-methyl-N-[(Z)-1-phenylbut-1-enyl]aniline
CID 24975986
N-[(E)-1-chloro-2-phenylethenyl]-N-methylaniline
CID 132574216
N,N-dimethoxy-1,2-diphenylethenamine
CID 90818413
(E)-2-(N-methylanilino)-3-phenylprop-2-enenitrile
CID 13147143
N-methyl-4-[(E)-2-[4-[methyl(phenyl)carbamoyl]phenyl]ethenyl]-N-phenylbenzamide
CID 134109031
(E)-N-methyl-N,3-diphenylbut-2-enamide
CID 11032331
3-[3-[methyl(phenyl)carbamoyl]phenyl]prop-2-enoic acid
CID 76907328
N-[(E)-2,3-diphenylprop-2-enyl]-N-methylformamide
CID 101473048
formic acid;methyl(phenyl)carbamic acid
CID 161284118

Frequently Asked Questions

What is the IUPAC name of N-(1,2-diphenylethenyl)-N-methylaniline?
The IUPAC name of N-(1,2-diphenylethenyl)-N-methylaniline (CID 76766210) is N-(1,2-diphenylethenyl)-N-methylaniline.
What is the SMILES notation for N-(1,2-diphenylethenyl)-N-methylaniline?
The canonical SMILES for N-(1,2-diphenylethenyl)-N-methylaniline is CN(C(=Cc1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(1,2-diphenylethenyl)-N-methylaniline?
The InChIKey is AFUVLFZTJGXFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N/c1-22(20-15-9-4-10-16-20)21(19-13-7-3-8-14-19)17-18-11-5-2-6-12-18/h2-17H,1H3.
What are the key properties of N-(1,2-diphenylethenyl)-N-methylaniline?
N-(1,2-diphenylethenyl)-N-methylaniline has a molecular weight of 285.39 g/mol, XLogP of 5.32, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-diphenylethenyl)-N-methylaniline is sourced from PubChem (CID 76766210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).