2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride

C10H22ClNO — CID 3028097

IUPAC2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride
SMILESCN(C)CC1CCCCC1(C)O.Cl
InChIInChI=1S/C10H21NO.ClH/c1-10(12)7-5-4-6-9(10)8-11(2)3;/h9,12H,4-8H2,1-3H3;1H
InChIKeyNQLQTWPTAALWLU-UHFFFAOYSA-N
MW207.74 g/mol
LogP1.91
Rot. Bonds2

About 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride

2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride (PubChem CID 3028097) has the molecular formula C10H22ClNO and a molecular weight of 207.74 g/mol. Its IUPAC name is 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride.

Molecular Properties

Compound Name2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride
PubChem CID3028097
Molecular FormulaC10H22ClNO
Molecular Weight207.74 g/mol
Exact Mass207.14
IUPAC Name2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride
SMILESCN(C)CC1CCCCC1(C)O.Cl
InChIInChI=1S/C10H21NO.ClH/c1-10(12)7-5-4-6-9(10)8-11(2)3;/h9,12H,4-8H2,1-3H3;1H
InChIKeyNQLQTWPTAALWLU-UHFFFAOYSA-N
XLogP1.91
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.74
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;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 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride?
The IUPAC name of 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride (CID 3028097) is 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride.
What is the SMILES notation for 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride?
The canonical SMILES for 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride is CN(C)CC1CCCCC1(C)O.Cl.
What is the InChIKey of 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride?
The InChIKey is NQLQTWPTAALWLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.ClH/c1-10(12)7-5-4-6-9(10)8-11(2)3;/h9,12H,4-8H2,1-3H3;1H.
What are the key properties of 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride?
2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride has a molecular weight of 207.74 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylamino)methyl]-1-methylcyclohexan-1-ol;hydrochloride is sourced from PubChem (CID 3028097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).