[4-(2,2-diphenylethyl)cyclohexyl]methanamine

C21H27N — CID 154511159

IUPAC[4-(2,2-diphenylethyl)cyclohexyl]methanamine
SMILESNCC1CCC(CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C21H27N/c22-16-18-13-11-17(12-14-18)15-21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16,22H2
InChIKeyDHYGDZKESAXGLE-UHFFFAOYSA-N
MW293.45 g/mol
LogP4.97
Rot. Bonds5

About [4-(2,2-diphenylethyl)cyclohexyl]methanamine

[4-(2,2-diphenylethyl)cyclohexyl]methanamine (PubChem CID 154511159) has the molecular formula C21H27N and a molecular weight of 293.45 g/mol. Its IUPAC name is [4-(2,2-diphenylethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-(2,2-diphenylethyl)cyclohexyl]methanamine
PubChem CID154511159
Molecular FormulaC21H27N
Molecular Weight293.45 g/mol
Exact Mass293.21
IUPAC Name[4-(2,2-diphenylethyl)cyclohexyl]methanamine
SMILESNCC1CCC(CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C21H27N/c22-16-18-13-11-17(12-14-18)15-21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16,22H2
InChIKeyDHYGDZKESAXGLE-UHFFFAOYSA-N
XLogP4.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.45
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [4-(2,2-diphenylethyl)cyclohexyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
The IUPAC name of [4-(2,2-diphenylethyl)cyclohexyl]methanamine (CID 154511159) is [4-(2,2-diphenylethyl)cyclohexyl]methanamine.
What is the SMILES notation for [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
The canonical SMILES for [4-(2,2-diphenylethyl)cyclohexyl]methanamine is NCC1CCC(CC(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
The InChIKey is DHYGDZKESAXGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N/c22-16-18-13-11-17(12-14-18)15-21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16,22H2.
What are the key properties of [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
[4-(2,2-diphenylethyl)cyclohexyl]methanamine has a molecular weight of 293.45 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-diphenylethyl)cyclohexyl]methanamine is sourced from PubChem (CID 154511159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).