1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol

C17H25NO2 — CID 54277612

IUPAC1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol
SMILESOC1CCC(c2ccc(N3CCC(O)CC3)cc2)CC1
InChIInChI=1S/C17H25NO2/c19-16-7-3-14(4-8-16)13-1-5-15(6-2-13)18-11-9-17(20)10-12-18/h1-2,5-6,14,16-17,19-20H,3-4,7-12H2
InChIKeyRONDRYMKNXWAPU-UHFFFAOYSA-N
MW275.39 g/mol
LogP2.67
Rot. Bonds2

About 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol

1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol (PubChem CID 54277612) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol
PubChem CID54277612
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol
SMILESOC1CCC(c2ccc(N3CCC(O)CC3)cc2)CC1
InChIInChI=1S/C17H25NO2/c19-16-7-3-14(4-8-16)13-1-5-15(6-2-13)18-11-9-17(20)10-12-18/h1-2,5-6,14,16-17,19-20H,3-4,7-12H2
InChIKeyRONDRYMKNXWAPU-UHFFFAOYSA-N
XLogP2.67
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-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 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol?
The IUPAC name of 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol (CID 54277612) is 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol.
What is the SMILES notation for 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol?
The canonical SMILES for 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol is OC1CCC(c2ccc(N3CCC(O)CC3)cc2)CC1.
What is the InChIKey of 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol?
The InChIKey is RONDRYMKNXWAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c19-16-7-3-14(4-8-16)13-1-5-15(6-2-13)18-11-9-17(20)10-12-18/h1-2,5-6,14,16-17,19-20H,3-4,7-12H2.
What are the key properties of 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol?
1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol has a molecular weight of 275.39 g/mol, XLogP of 2.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-hydroxycyclohexyl)phenyl]piperidin-4-ol is sourced from PubChem (CID 54277612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).