5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride

C8H18ClNO — CID 89158271

IUPAC5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride
SMILESCC1(C)CCC(N)CC1O.Cl
InChIInChI=1S/C8H17NO.ClH/c1-8(2)4-3-6(9)5-7(8)10;/h6-7,10H,3-5,9H2,1-2H3;1H
InChIKeyJKCNWOQIDZDLSO-UHFFFAOYSA-N
MW179.69 g/mol
LogP1.31
Rot. Bonds

About 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride

5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride (PubChem CID 89158271) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride.

Molecular Properties

Compound Name5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride
PubChem CID89158271
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride
SMILESCC1(C)CCC(N)CC1O.Cl
InChIInChI=1S/C8H17NO.ClH/c1-8(2)4-3-6(9)5-7(8)10;/h6-7,10H,3-5,9H2,1-2H3;1H
InChIKeyJKCNWOQIDZDLSO-UHFFFAOYSA-N
XLogP1.31
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-amino-2,2-dimethylcyclohexan-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 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride?
The IUPAC name of 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride (CID 89158271) is 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride.
What is the SMILES notation for 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride?
The canonical SMILES for 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride is CC1(C)CCC(N)CC1O.Cl.
What is the InChIKey of 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride?
The InChIKey is JKCNWOQIDZDLSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-8(2)4-3-6(9)5-7(8)10;/h6-7,10H,3-5,9H2,1-2H3;1H.
What are the key properties of 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride?
5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 1.31, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride is sourced from PubChem (CID 89158271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).