N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine

C18H19N — CID 144645391

IUPACN-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine
SMILESCC(C)=C(/N=C(\C)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H19N/c1-14(2)18(17-12-8-5-9-13-17)19-15(3)16-10-6-4-7-11-16/h4-13H,1-3H3/b19-15+
InChIKeyQYIGPZAABKCZTB-XDJHFCHBSA-N
MW249.36 g/mol
LogP4.95
Rot. Bonds3

About N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine

N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine (PubChem CID 144645391) has the molecular formula C18H19N and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine.

Molecular Properties

Compound NameN-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine
PubChem CID144645391
Molecular FormulaC18H19N
Molecular Weight249.36 g/mol
Exact Mass249.15
IUPAC NameN-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine
SMILESCC(C)=C(/N=C(\C)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H19N/c1-14(2)18(17-12-8-5-9-13-17)19-15(3)16-10-6-4-7-11-16/h4-13H,1-3H3/b19-15+
InChIKeyQYIGPZAABKCZTB-XDJHFCHBSA-N
XLogP4.95
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[C-chloro-N-(2-methyl-1-phenylprop-1-enyl)carbonimidoyl]benzenecarboximidoyl iodide
CID 174142305
N-[(E)-1,2-diphenylethenyl]-1-phenylethanimine
CID 14709228
N-[(3Z)-2-methylpenta-1,3-dien-3-yl]-1-phenylethanimine
CID 126661807
1-(benzhydrylideneamino)ethylidenechromium
CID 11463699
N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline
CID 102364701
1-phenyl-N-[(E)-prop-1-enyl]ethanimine
CID 13099167
1-(4-bromophenyl)-N-[(Z)-1-phenylprop-1-enyl]ethanimine
CID 145462827
ethane;N'-[(Z)-2-(methylideneamino)-1,2-diphenylethenyl]ethanimidamide
CID 145436814
N-cyclopropyl-N-[(E)-1-phenylethylideneamino]cyclopropanamine
CID 177445849
N-(1-carbazol-9-ylethenyl)-1-phenylethanimine
CID 174072422
nickel(2+);bis(1-(1-phenylethylidenehydrazinylidene)-1-sulfidoethane)
CID 5245817
2-(1-phenylethylideneamino)phenol
CID 12750817

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine?
The IUPAC name of N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine (CID 144645391) is N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine.
What is the SMILES notation for N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine?
The canonical SMILES for N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine is CC(C)=C(/N=C(\C)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine?
The InChIKey is QYIGPZAABKCZTB-XDJHFCHBSA-N. The full InChI is InChI=1S/C18H19N/c1-14(2)18(17-12-8-5-9-13-17)19-15(3)16-10-6-4-7-11-16/h4-13H,1-3H3/b19-15+.
What are the key properties of N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine?
N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine has a molecular weight of 249.36 g/mol, XLogP of 4.95, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylprop-1-enyl)-1-phenylethanimine is sourced from PubChem (CID 144645391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).