4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol

C11H19NO2 — CID 130816288

IUPAC4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol
SMILESOC1CCC(N2CC3CC2CO3)CC1
InChIInChI=1S/C11H19NO2/c13-10-3-1-8(2-4-10)12-6-11-5-9(12)7-14-11/h8-11,13H,1-7H2
InChIKeySXHFRLSJPXGSPC-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.76
Rot. Bonds1

About 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol

4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol (PubChem CID 130816288) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol
PubChem CID130816288
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol
SMILESOC1CCC(N2CC3CC2CO3)CC1
InChIInChI=1S/C11H19NO2/c13-10-3-1-8(2-4-10)12-6-11-5-9(12)7-14-11/h8-11,13H,1-7H2
InChIKeySXHFRLSJPXGSPC-UHFFFAOYSA-N
XLogP0.76
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-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-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol (CID 130816288) is 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol is OC1CCC(N2CC3CC2CO3)CC1.
What is the InChIKey of 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol?
The InChIKey is SXHFRLSJPXGSPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-10-3-1-8(2-4-10)12-6-11-5-9(12)7-14-11/h8-11,13H,1-7H2.
What are the key properties of 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol?
4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol has a molecular weight of 197.28 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclohexan-1-ol is sourced from PubChem (CID 130816288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).