N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline

C24H25N — CID 20813134

IUPACN-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline
SMILESCc1ccc(Nc2ccc(/C=C/c3cccc(C)c3C)cc2)c(C)c1
InChIInChI=1S/C24H25N/c1-17-8-15-24(19(3)16-17)25-23-13-10-21(11-14-23)9-12-22-7-5-6-18(2)20(22)4/h5-16,25H,1-4H3/b12-9+
InChIKeyIPPVCECCBNREHV-FMIVXFBMSA-N
MW327.47 g/mol
LogP6.83
Rot. Bonds4

About N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline

N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline (PubChem CID 20813134) has the molecular formula C24H25N and a molecular weight of 327.47 g/mol. Its IUPAC name is N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline.

Molecular Properties

Compound NameN-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline
PubChem CID20813134
Molecular FormulaC24H25N
Molecular Weight327.47 g/mol
Exact Mass327.20
IUPAC NameN-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline
SMILESCc1ccc(Nc2ccc(/C=C/c3cccc(C)c3C)cc2)c(C)c1
InChIInChI=1S/C24H25N/c1-17-8-15-24(19(3)16-17)25-23-13-10-21(11-14-23)9-12-22-7-5-6-18(2)20(22)4/h5-16,25H,1-4H3/b12-9+
InChIKeyIPPVCECCBNREHV-FMIVXFBMSA-N
XLogP6.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.47
LogP ≤ 56.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[4-[2-(2,3-dimethylphenyl)ethenyl]phenyl]butan-2-yl]-2,4-dimethylaniline
CID 122484936
N-[4-[(E)-2-(3-methoxyphenyl)ethenyl]phenyl]-2,4-dimethylaniline
CID 20813152
1-[(Z)-2-(2,3-dimethylphenyl)ethenyl]-2,3-dimethylbenzene
CID 135028757
N-(4-methylphenyl)-2-[(E)-2-[2-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
CID 67688103
N-[4-[(E)-2-(2,4-dimethylphenyl)-2-phenylethenyl]phenyl]-2,4-dimethylaniline
CID 20813136
4-N-(2,4-dimethylphenyl)-1-N-(3,4-dimethylphenyl)benzene-1,4-diamine
CID 101290973
2-(3-methylphenyl)-N-[4-[2-[4-[2-(3-methylphenyl)anilino]phenyl]ethenyl]phenyl]aniline
CID 70171398
4-(2,4-dimethylanilino)benzonitrile
CID 29269980
2,4-dimethyl-1-[(E)-2-(4-methylphenyl)ethenyl]benzene;methane
CID 161062923
2-[2-[4-[2-(2,5-dimethylphenyl)ethenyl]phenyl]ethenyl]-1,4-dimethylbenzene
CID 71374373
2,4-dimethyl-1-[(E)-2-phenylethenyl]benzene
CID 15751246
3-[(E)-2-[4-(4-methylanilino)phenyl]ethenyl]phenol
CID 67605326

Frequently Asked Questions

What is the IUPAC name of N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline?
The IUPAC name of N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline (CID 20813134) is N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline.
What is the SMILES notation for N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline?
The canonical SMILES for N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline is Cc1ccc(Nc2ccc(/C=C/c3cccc(C)c3C)cc2)c(C)c1.
What is the InChIKey of N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline?
The InChIKey is IPPVCECCBNREHV-FMIVXFBMSA-N. The full InChI is InChI=1S/C24H25N/c1-17-8-15-24(19(3)16-17)25-23-13-10-21(11-14-23)9-12-22-7-5-6-18(2)20(22)4/h5-16,25H,1-4H3/b12-9+.
What are the key properties of N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline?
N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline has a molecular weight of 327.47 g/mol, XLogP of 6.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(E)-2-(2,3-dimethylphenyl)ethenyl]phenyl]-2,4-dimethylaniline is sourced from PubChem (CID 20813134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).