2-(aminomethyl)-5-methylcyclohexan-1-amine

C8H18N2 — CID 62070304

IUPAC2-(aminomethyl)-5-methylcyclohexan-1-amine
SMILESCC1CCC(CN)C(N)C1
InChIInChI=1S/C8H18N2/c1-6-2-3-7(5-9)8(10)4-6/h6-8H,2-5,9-10H2,1H3
InChIKeyZXWUMSRYMMCECY-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.71
Rot. Bonds1

About 2-(aminomethyl)-5-methylcyclohexan-1-amine

2-(aminomethyl)-5-methylcyclohexan-1-amine (PubChem CID 62070304) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 2-(aminomethyl)-5-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-5-methylcyclohexan-1-amine
PubChem CID62070304
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name2-(aminomethyl)-5-methylcyclohexan-1-amine
SMILESCC1CCC(CN)C(N)C1
InChIInChI=1S/C8H18N2/c1-6-2-3-7(5-9)8(10)4-6/h6-8H,2-5,9-10H2,1H3
InChIKeyZXWUMSRYMMCECY-UHFFFAOYSA-N
XLogP0.71
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(aminomethyl)-5-methylcyclohexan-1-amine 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 2-(aminomethyl)-5-methylcyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-5-methylcyclohexan-1-amine (CID 62070304) is 2-(aminomethyl)-5-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-5-methylcyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-5-methylcyclohexan-1-amine is CC1CCC(CN)C(N)C1.
What is the InChIKey of 2-(aminomethyl)-5-methylcyclohexan-1-amine?
The InChIKey is ZXWUMSRYMMCECY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-6-2-3-7(5-9)8(10)4-6/h6-8H,2-5,9-10H2,1H3.
What are the key properties of 2-(aminomethyl)-5-methylcyclohexan-1-amine?
2-(aminomethyl)-5-methylcyclohexan-1-amine has a molecular weight of 142.25 g/mol, XLogP of 0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-5-methylcyclohexan-1-amine is sourced from PubChem (CID 62070304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).