3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide

C23H21NO — CID 121493703

IUPAC3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(/C(=C/c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H21NO/c1-24(2)23(25)21-15-9-14-20(17-21)22(19-12-7-4-8-13-19)16-18-10-5-3-6-11-18/h3-17H,1-2H3/b22-16+
InChIKeyUJXZVZJHBQORAD-CJLVFECKSA-N
MW327.43 g/mol
LogP4.98
Rot. Bonds4

About 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide

3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide (PubChem CID 121493703) has the molecular formula C23H21NO and a molecular weight of 327.43 g/mol. Its IUPAC name is 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide
PubChem CID121493703
Molecular FormulaC23H21NO
Molecular Weight327.43 g/mol
Exact Mass327.16
IUPAC Name3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(/C(=C/c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H21NO/c1-24(2)23(25)21-15-9-14-20(17-21)22(19-12-7-4-8-13-19)16-18-10-5-3-6-11-18/h3-17H,1-2H3/b22-16+
InChIKeyUJXZVZJHBQORAD-CJLVFECKSA-N
XLogP4.98
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[3-[(E)-1,2-diphenylethenyl]phenyl]ethanone
CID 121493701
2-[(E)-1,2-diphenylethenyl]-N,N,4-trimethylbenzamide
CID 71527195
CID 173126547
CID 173126547
1-[(E)-1,2-diphenylethenyl]-3-phenylbenzene
CID 121493700
CID 172843956
CID 172843956
1,2-diphenylethenylbenzene;2-methylphenol
CID 159908422
1-[(E)-1,2-diphenylethenyl]-3,5-dimethylbenzene
CID 102283566
1-[4-[N-(4-acetylphenyl)-4-(2,2-diphenylethenyl)anilino]phenyl]ethanone
CID 91417911
1-[(Z)-1,2-diphenylethenyl]-4-[4-[(Z)-1,2-diphenylethenyl]phenyl]benzene
CID 173002469
2-[[3-(dimethylcarbamoyl)benzoyl]-methylamino]-2-methylpropanoic acid
CID 120518687
N-[4-(2,2-diphenylethenyl)phenyl]-N,4-dimethylaniline
CID 14549602
4-[(Z)-2-[3-[(E)-2-[4-(diethylamino)phenyl]-2-phenylethenyl]phenyl]-1-phenylethenyl]-N,N-diethylaniline
CID 59935157

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide?
The IUPAC name of 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide (CID 121493703) is 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide?
The canonical SMILES for 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide is CN(C)C(=O)c1cccc(/C(=C/c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide?
The InChIKey is UJXZVZJHBQORAD-CJLVFECKSA-N. The full InChI is InChI=1S/C23H21NO/c1-24(2)23(25)21-15-9-14-20(17-21)22(19-12-7-4-8-13-19)16-18-10-5-3-6-11-18/h3-17H,1-2H3/b22-16+.
What are the key properties of 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide?
3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide has a molecular weight of 327.43 g/mol, XLogP of 4.98, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-1,2-diphenylethenyl]-N,N-dimethylbenzamide is sourced from PubChem (CID 121493703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).