[1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine

C16H32N2 — CID 64761359

IUPAC[1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine
SMILESCC1CCC(CN)(N2CCCC(C)C2C)C(C)C1
InChIInChI=1S/C16H32N2/c1-12-7-8-16(11-17,14(3)10-12)18-9-5-6-13(2)15(18)4/h12-15H,5-11,17H2,1-4H3
InChIKeyGHQVQJYEMZKXPI-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.26
Rot. Bonds2

About [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine

[1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine (PubChem CID 64761359) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine
PubChem CID64761359
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name[1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine
SMILESCC1CCC(CN)(N2CCCC(C)C2C)C(C)C1
InChIInChI=1S/C16H32N2/c1-12-7-8-16(11-17,14(3)10-12)18-9-5-6-13(2)15(18)4/h12-15H,5-11,17H2,1-4H3
InChIKeyGHQVQJYEMZKXPI-UHFFFAOYSA-N
XLogP3.26
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]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 [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine?
The IUPAC name of [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine (CID 64761359) is [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine.
What is the SMILES notation for [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine?
The canonical SMILES for [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine is CC1CCC(CN)(N2CCCC(C)C2C)C(C)C1.
What is the InChIKey of [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine?
The InChIKey is GHQVQJYEMZKXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12-7-8-16(11-17,14(3)10-12)18-9-5-6-13(2)15(18)4/h12-15H,5-11,17H2,1-4H3.
What are the key properties of [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine?
[1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine has a molecular weight of 252.45 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dimethylpiperidin-1-yl)-2,4-dimethylcyclohexyl]methanamine is sourced from PubChem (CID 64761359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).