N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline

C24H23N — CID 132506209

IUPACN,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
SMILESCN(C)c1ccc(/C=C/c2ccc(/C=C/c3ccccc3)cc2)cc1
InChIInChI=1S/C24H23N/c1-25(2)24-18-16-23(17-19-24)15-14-22-12-10-21(11-13-22)9-8-20-6-4-3-5-7-20/h3-19H,1-2H3/b9-8+,15-14+
InChIKeyTUVYKDQGPVGGTH-IDRAWEHWSA-N
MW325.45 g/mol
LogP6.09
Rot. Bonds5

About N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline

N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline (PubChem CID 132506209) has the molecular formula C24H23N and a molecular weight of 325.45 g/mol. Its IUPAC name is N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
PubChem CID132506209
Molecular FormulaC24H23N
Molecular Weight325.45 g/mol
Exact Mass325.18
IUPAC NameN,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
SMILESCN(C)c1ccc(/C=C/c2ccc(/C=C/c3ccccc3)cc2)cc1
InChIInChI=1S/C24H23N/c1-25(2)24-18-16-23(17-19-24)15-14-22-12-10-21(11-13-22)9-8-20-6-4-3-5-7-20/h3-19H,1-2H3/b9-8+,15-14+
InChIKeyTUVYKDQGPVGGTH-IDRAWEHWSA-N
XLogP6.09
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.45
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-4-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]aniline
CID 6015156
N,N-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]aniline
CID 10875699
4-[(Z)-2-[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]ethenyl]-N,N-dimethylaniline
CID 92530704
4-N-[4-[(E)-2-[4-[(E)-2-[4-[4-(dimethylamino)-N-[4-(dimethylamino)phenyl]anilino]phenyl]ethenyl]phenyl]ethenyl]phenyl]-4-N-[4-(dimethylamino)phenyl]-1-N,1-N-dimethylbenzene-1,4-diamine
CID 166784252
N,N-dimethylmethanamine;stilbene
CID 174368184
bis[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]-phenylmethanol
CID 15868831
[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]-phenylmethanone
CID 132506208
[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]-diphenylmethanol
CID 11036914
N,N-dimethyl-4-[(E)-2-(3-methylphenyl)ethenyl]aniline
CID 6538430
4-N-[4-[2-[6-[2-[4-(N-[4-(dimethylamino)phenyl]anilino)phenyl]ethenyl]naphthalen-2-yl]ethenyl]phenyl]-1-N,1-N-dimethyl-4-N-phenylbenzene-1,4-diamine
CID 59923921
4-[(E)-2-(4-iodophenyl)ethenyl]-N,N-dimethylaniline
CID 10936986
4-[(E)-2-(2-fluorophenyl)ethenyl]-N,N-dimethylaniline
CID 6538416

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline?
The IUPAC name of N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline (CID 132506209) is N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline.
What is the SMILES notation for N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline?
The canonical SMILES for N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline is CN(C)c1ccc(/C=C/c2ccc(/C=C/c3ccccc3)cc2)cc1.
What is the InChIKey of N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline?
The InChIKey is TUVYKDQGPVGGTH-IDRAWEHWSA-N. The full InChI is InChI=1S/C24H23N/c1-25(2)24-18-16-23(17-19-24)15-14-22-12-10-21(11-13-22)9-8-20-6-4-3-5-7-20/h3-19H,1-2H3/b9-8+,15-14+.
What are the key properties of N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline?
N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline has a molecular weight of 325.45 g/mol, XLogP of 6.09, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline is sourced from PubChem (CID 132506209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).