(E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine

C25H24ClNO — CID 163360592

IUPAC(E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine
SMILESCc1c(CON/C=C(/c2ccc(Cl)cc2)C2CC2)cccc1-c1ccccc1
InChIInChI=1S/C25H24ClNO/c1-18-22(8-5-9-24(18)19-6-3-2-4-7-19)17-28-27-16-25(20-10-11-20)21-12-14-23(26)15-13-21/h2-9,12-16,20,27H,10-11,17H2,1H3/b25-16+
InChIKeySKQNGRQYDKNENW-PCLIKHOPSA-N
MW389.93 g/mol
LogP6.79
Rot. Bonds7

About (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine

(E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine (PubChem CID 163360592) has the molecular formula C25H24ClNO and a molecular weight of 389.93 g/mol. Its IUPAC name is (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine.

Molecular Properties

Compound Name(E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine
PubChem CID163360592
Molecular FormulaC25H24ClNO
Molecular Weight389.93 g/mol
Exact Mass389.15
IUPAC Name(E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine
SMILESCc1c(CON/C=C(/c2ccc(Cl)cc2)C2CC2)cccc1-c1ccccc1
InChIInChI=1S/C25H24ClNO/c1-18-22(8-5-9-24(18)19-6-3-2-4-7-19)17-28-27-16-25(20-10-11-20)21-12-14-23(26)15-13-21/h2-9,12-16,20,27H,10-11,17H2,1H3/b25-16+
InChIKeySKQNGRQYDKNENW-PCLIKHOPSA-N
XLogP6.79
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.93
LogP ≤ 56.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine 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

(E)-(4-Chlorophenyl)(cyclopropyl)methanone O-((2-methyl[biphenyl]-3-yl)methyl)oxime
CID 5491592
1-(4-Chlorophenyl)-1-cyclopropyl-n-((2-methyl-3-phenylphenyl)methoxy)methanimine
CID 9578050
1-(4-chlorophenyl)-1-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]methanimine
CID 180602
(E)-1-(4-chlorophenyl)-1-cyclopropyl-N-[(2,4-dimethyl-3-phenylphenyl)methoxy]methanimine
CID 13282526
(E)-1-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethanimine
CID 13282540
(E)-1-(4-chlorophenyl)-2-methyl-N-[(2-methyl-3-phenylphenyl)methoxy]propan-1-imine
CID 13282541
1-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethanimine
CID 53693224
1-(4-chlorophenyl)-1-cyclopropyl-N-[(2,6-dimethyl-3-phenylphenyl)methoxy]methanimine
CID 53771793
1-(4-chlorophenyl)-1-cyclopropylidene-N-[(2,6-dimethyl-3-phenylphenyl)methoxy]methanamine
CID 53836411
1-(4-chlorophenyl)-1-cyclopropyl-N-[(2,4-dimethyl-3-phenylphenyl)methoxy]methanimine
CID 53945699
1-(4-chlorophenyl)-2-methyl-N-[(2-methyl-3-phenylphenyl)methoxy]propan-1-imine
CID 53989989
1-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine
CID 54042841

Frequently Asked Questions

What is the IUPAC name of (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine?
The IUPAC name of (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine (CID 163360592) is (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine.
What is the SMILES notation for (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine?
The canonical SMILES for (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine is Cc1c(CON/C=C(/c2ccc(Cl)cc2)C2CC2)cccc1-c1ccccc1.
What is the InChIKey of (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine?
The InChIKey is SKQNGRQYDKNENW-PCLIKHOPSA-N. The full InChI is InChI=1S/C25H24ClNO/c1-18-22(8-5-9-24(18)19-6-3-2-4-7-19)17-28-27-16-25(20-10-11-20)21-12-14-23(26)15-13-21/h2-9,12-16,20,27H,10-11,17H2,1H3/b25-16+.
What are the key properties of (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine?
(E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine has a molecular weight of 389.93 g/mol, XLogP of 6.79, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-methyl-3-phenylphenyl)methoxy]ethenamine is sourced from PubChem (CID 163360592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).