1,2-dimethylcyclohexan-1-amine;hydrochloride

C8H18ClN — CID 3021678

IUPAC1,2-dimethylcyclohexan-1-amine;hydrochloride
SMILESCC1CCCCC1(C)N.Cl
InChIInChI=1S/C8H17N.ClH/c1-7-5-3-4-6-8(7,2)9;/h7H,3-6,9H2,1-2H3;1H
InChIKeySZBMJCMKBWDHKS-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.34
Rot. Bonds

About 1,2-dimethylcyclohexan-1-amine;hydrochloride

1,2-dimethylcyclohexan-1-amine;hydrochloride (PubChem CID 3021678) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is 1,2-dimethylcyclohexan-1-amine;hydrochloride.

Molecular Properties

Compound Name1,2-dimethylcyclohexan-1-amine;hydrochloride
PubChem CID3021678
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC Name1,2-dimethylcyclohexan-1-amine;hydrochloride
SMILESCC1CCCCC1(C)N.Cl
InChIInChI=1S/C8H17N.ClH/c1-7-5-3-4-6-8(7,2)9;/h7H,3-6,9H2,1-2H3;1H
InChIKeySZBMJCMKBWDHKS-UHFFFAOYSA-N
XLogP2.34
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1,2-dimethylcyclohexan-1-amine;hydrochloride 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-dimethylcyclohexan-1-amine;hydrochloride?
The IUPAC name of 1,2-dimethylcyclohexan-1-amine;hydrochloride (CID 3021678) is 1,2-dimethylcyclohexan-1-amine;hydrochloride.
What is the SMILES notation for 1,2-dimethylcyclohexan-1-amine;hydrochloride?
The canonical SMILES for 1,2-dimethylcyclohexan-1-amine;hydrochloride is CC1CCCCC1(C)N.Cl.
What is the InChIKey of 1,2-dimethylcyclohexan-1-amine;hydrochloride?
The InChIKey is SZBMJCMKBWDHKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-7-5-3-4-6-8(7,2)9;/h7H,3-6,9H2,1-2H3;1H.
What are the key properties of 1,2-dimethylcyclohexan-1-amine;hydrochloride?
1,2-dimethylcyclohexan-1-amine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.34, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylcyclohexan-1-amine;hydrochloride is sourced from PubChem (CID 3021678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).