4-iminocyclohexan-1-ol

C6H11NO — CID 59686949

IUPAC4-iminocyclohexan-1-ol
SMILES[H]N=C1CCC(O)CC1
InChIInChI=1S/C6H11NO/c7-5-1-3-6(8)4-2-5/h6-8H,1-4H2/b7-5-
InChIKeyYQIWJXCKALWWNV-ALCCZGGFSA-N
MW113.16 g/mol
LogP0.94
Rot. Bonds

About 4-iminocyclohexan-1-ol

4-iminocyclohexan-1-ol (PubChem CID 59686949) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 4-iminocyclohexan-1-ol.

Molecular Properties

Compound Name4-iminocyclohexan-1-ol
PubChem CID59686949
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name4-iminocyclohexan-1-ol
SMILES[H]N=C1CCC(O)CC1
InChIInChI=1S/C6H11NO/c7-5-1-3-6(8)4-2-5/h6-8H,1-4H2/b7-5-
InChIKeyYQIWJXCKALWWNV-ALCCZGGFSA-N
XLogP0.94
TPSA44.08 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 4-iminocyclohexan-1-ol 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 4-iminocyclohexan-1-ol?
The IUPAC name of 4-iminocyclohexan-1-ol (CID 59686949) is 4-iminocyclohexan-1-ol.
What is the SMILES notation for 4-iminocyclohexan-1-ol?
The canonical SMILES for 4-iminocyclohexan-1-ol is [H]N=C1CCC(O)CC1.
What is the InChIKey of 4-iminocyclohexan-1-ol?
The InChIKey is YQIWJXCKALWWNV-ALCCZGGFSA-N. The full InChI is InChI=1S/C6H11NO/c7-5-1-3-6(8)4-2-5/h6-8H,1-4H2/b7-5-.
What are the key properties of 4-iminocyclohexan-1-ol?
4-iminocyclohexan-1-ol has a molecular weight of 113.16 g/mol, XLogP of 0.94, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iminocyclohexan-1-ol is sourced from PubChem (CID 59686949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).