(E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine

C25H26N2O — CID 45272940

IUPAC(E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine
SMILESCC1/C(=N/OCc2ccccc2)CC(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C25H26N2O/c1-19-23(27-28-18-20-11-5-2-6-12-20)17-24(21-13-7-3-8-14-21)26-25(19)22-15-9-4-10-16-22/h2-16,19,24-26H,17-18H2,1H3/b27-23+
InChIKeyYNCUBWWVYADNTK-SLEBQGDGSA-N
MW370.50 g/mol
LogP5.67
Rot. Bonds5

About (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine

(E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine (PubChem CID 45272940) has the molecular formula C25H26N2O and a molecular weight of 370.50 g/mol. Its IUPAC name is (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine.

Molecular Properties

Compound Name(E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine
PubChem CID45272940
Molecular FormulaC25H26N2O
Molecular Weight370.50 g/mol
Exact Mass370.20
IUPAC Name(E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine
SMILESCC1/C(=N/OCc2ccccc2)CC(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C25H26N2O/c1-19-23(27-28-18-20-11-5-2-6-12-20)17-24(21-13-7-3-8-14-21)26-25(19)22-15-9-4-10-16-22/h2-16,19,24-26H,17-18H2,1H3/b27-23+
InChIKeyYNCUBWWVYADNTK-SLEBQGDGSA-N
XLogP5.67
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.50
LogP ≤ 55.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine 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

(NZ)-N-[(2R,3R,6S)-3-methyl-2,6-diphenylpiperidin-4-ylidene]hydroxylamine
CID 7243018
(NZ)-N-[(2R,3S,6S)-3-methyl-2,6-diphenylpiperidin-4-ylidene]hydroxylamine
CID 5400258
N-(3-benzyl-2,6-diphenylpiperidin-4-ylidene)hydroxylamine
CID 3089029
N-[(2R,3S,6S)-3-benzyl-2,6-diphenylpiperidin-4-ylidene]hydroxylamine
CID 7073015
3-[(E)-(3-methyl-2,6-diphenylpiperidin-4-ylidene)amino]-2-sulfanylideneimidazolidin-4-one
CID 46225576
(NZ)-N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine
CID 171985956
N-[3-methyl-2,6-bis(4-methylphenyl)piperidin-4-ylidene]hydroxylamine
CID 4711818
(2R,3R,4R,6R)-4-benzyl-3-methyl-2,6-diphenylpiperidin-4-ol
CID 124714824
(2R,3R,4S,6S)-4-benzyl-3-methyl-2,6-diphenylpiperidin-4-ol
CID 98713917
(E)-2,6-bis(4-methoxyphenyl)-1,3-dimethyl-N-phenylmethoxypiperidin-4-imine
CID 16728367
(NE)-N-[(2S,3R,6S)-2,6-bis(4-chlorophenyl)-3-methylpiperidin-4-ylidene]hydroxylamine
CID 7407907
(NE)-N-[(2R,3S,6R)-2,6-bis(4-chlorophenyl)-3-methylpiperidin-4-ylidene]hydroxylamine
CID 6341275

Frequently Asked Questions

What is the IUPAC name of (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine?
The IUPAC name of (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine (CID 45272940) is (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine.
What is the SMILES notation for (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine?
The canonical SMILES for (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine is CC1/C(=N/OCc2ccccc2)CC(c2ccccc2)NC1c1ccccc1.
What is the InChIKey of (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine?
The InChIKey is YNCUBWWVYADNTK-SLEBQGDGSA-N. The full InChI is InChI=1S/C25H26N2O/c1-19-23(27-28-18-20-11-5-2-6-12-20)17-24(21-13-7-3-8-14-21)26-25(19)22-15-9-4-10-16-22/h2-16,19,24-26H,17-18H2,1H3/b27-23+.
What are the key properties of (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine?
(E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine has a molecular weight of 370.50 g/mol, XLogP of 5.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-methyl-2,6-diphenyl-N-phenylmethoxypiperidin-4-imine is sourced from PubChem (CID 45272940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).