4-phenyliminocyclohexan-1-ol

C12H15NO — CID 19962596

IUPAC4-phenyliminocyclohexan-1-ol
SMILESOC1CCC(=Nc2ccccc2)CC1
InChIInChI=1S/C12H15NO/c14-12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-5,12,14H,6-9H2/b13-11-
InChIKeyZXQLAXROYGJJCE-QBFSEMIESA-N
MW189.26 g/mol
LogP2.69
Rot. Bonds1

About 4-phenyliminocyclohexan-1-ol

4-phenyliminocyclohexan-1-ol (PubChem CID 19962596) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 4-phenyliminocyclohexan-1-ol.

Molecular Properties

Compound Name4-phenyliminocyclohexan-1-ol
PubChem CID19962596
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name4-phenyliminocyclohexan-1-ol
SMILESOC1CCC(=Nc2ccccc2)CC1
InChIInChI=1S/C12H15NO/c14-12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-5,12,14H,6-9H2/b13-11-
InChIKeyZXQLAXROYGJJCE-QBFSEMIESA-N
XLogP2.69
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-phenyliminocyclohexan-1-ol?
The IUPAC name of 4-phenyliminocyclohexan-1-ol (CID 19962596) is 4-phenyliminocyclohexan-1-ol.
What is the SMILES notation for 4-phenyliminocyclohexan-1-ol?
The canonical SMILES for 4-phenyliminocyclohexan-1-ol is OC1CCC(=Nc2ccccc2)CC1.
What is the InChIKey of 4-phenyliminocyclohexan-1-ol?
The InChIKey is ZXQLAXROYGJJCE-QBFSEMIESA-N. The full InChI is InChI=1S/C12H15NO/c14-12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-5,12,14H,6-9H2/b13-11-.
What are the key properties of 4-phenyliminocyclohexan-1-ol?
4-phenyliminocyclohexan-1-ol has a molecular weight of 189.26 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyliminocyclohexan-1-ol is sourced from PubChem (CID 19962596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).