1-methylcyclohexan-1-amine;hydrochloride

C7H16ClN — CID 3021577

IUPAC1-methylcyclohexan-1-amine;hydrochloride
SMILESCC1(N)CCCCC1.Cl
InChIInChI=1S/C7H15N.ClH/c1-7(8)5-3-2-4-6-7;/h2-6,8H2,1H3;1H
InChIKeyVNLCPYWZTADPJD-UHFFFAOYSA-N
MW149.66 g/mol
LogP2.09
Rot. Bonds

About 1-methylcyclohexan-1-amine;hydrochloride

1-methylcyclohexan-1-amine;hydrochloride (PubChem CID 3021577) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is 1-methylcyclohexan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-methylcyclohexan-1-amine;hydrochloride
PubChem CID3021577
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Name1-methylcyclohexan-1-amine;hydrochloride
SMILESCC1(N)CCCCC1.Cl
InChIInChI=1S/C7H15N.ClH/c1-7(8)5-3-2-4-6-7;/h2-6,8H2,1H3;1H
InChIKeyVNLCPYWZTADPJD-UHFFFAOYSA-N
XLogP2.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.66
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-methylcyclohexan-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-methylcyclohexan-1-amine;hydrochloride?
The IUPAC name of 1-methylcyclohexan-1-amine;hydrochloride (CID 3021577) is 1-methylcyclohexan-1-amine;hydrochloride.
What is the SMILES notation for 1-methylcyclohexan-1-amine;hydrochloride?
The canonical SMILES for 1-methylcyclohexan-1-amine;hydrochloride is CC1(N)CCCCC1.Cl.
What is the InChIKey of 1-methylcyclohexan-1-amine;hydrochloride?
The InChIKey is VNLCPYWZTADPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.ClH/c1-7(8)5-3-2-4-6-7;/h2-6,8H2,1H3;1H.
What are the key properties of 1-methylcyclohexan-1-amine;hydrochloride?
1-methylcyclohexan-1-amine;hydrochloride has a molecular weight of 149.66 g/mol, XLogP of 2.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylcyclohexan-1-amine;hydrochloride is sourced from PubChem (CID 3021577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).