3-azabicyclo[3.1.0]hexan-6-ylmethanol

C6H11NO — CID 11815839

IUPAC3-azabicyclo[3.1.0]hexan-6-ylmethanol
SMILESOCC1C2CNCC12
InChIInChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2
InChIKeyYGYOQZPGFXHQMW-UHFFFAOYSA-N
MW113.16 g/mol
LogP-0.56
Rot. Bonds1

About 3-azabicyclo[3.1.0]hexan-6-ylmethanol

3-azabicyclo[3.1.0]hexan-6-ylmethanol (PubChem CID 11815839) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 3-azabicyclo[3.1.0]hexan-6-ylmethanol.

Molecular Properties

Compound Name3-azabicyclo[3.1.0]hexan-6-ylmethanol
PubChem CID11815839
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name3-azabicyclo[3.1.0]hexan-6-ylmethanol
SMILESOCC1C2CNCC12
InChIInChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2
InChIKeyYGYOQZPGFXHQMW-UHFFFAOYSA-N
XLogP-0.56
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-azabicyclo[3.1.0]hexan-6-ylmethanol 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 3-azabicyclo[3.1.0]hexan-6-ylmethanol?
The IUPAC name of 3-azabicyclo[3.1.0]hexan-6-ylmethanol (CID 11815839) is 3-azabicyclo[3.1.0]hexan-6-ylmethanol.
What is the SMILES notation for 3-azabicyclo[3.1.0]hexan-6-ylmethanol?
The canonical SMILES for 3-azabicyclo[3.1.0]hexan-6-ylmethanol is OCC1C2CNCC12.
What is the InChIKey of 3-azabicyclo[3.1.0]hexan-6-ylmethanol?
The InChIKey is YGYOQZPGFXHQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2.
What are the key properties of 3-azabicyclo[3.1.0]hexan-6-ylmethanol?
3-azabicyclo[3.1.0]hexan-6-ylmethanol has a molecular weight of 113.16 g/mol, XLogP of -0.56, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azabicyclo[3.1.0]hexan-6-ylmethanol is sourced from PubChem (CID 11815839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).