1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol

C11H20N2O — CID 83818752

IUPAC1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(CC2C3CNCC32)C1
InChIInChI=1S/C11H20N2O/c14-8-2-1-3-13(6-8)7-11-9-4-12-5-10(9)11/h8-12,14H,1-7H2
InChIKeyUFERRJWLFWGDJB-UHFFFAOYSA-N
MW196.29 g/mol
LogP-0.09
Rot. Bonds2

About 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol

1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol (PubChem CID 83818752) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol
PubChem CID83818752
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(CC2C3CNCC32)C1
InChIInChI=1S/C11H20N2O/c14-8-2-1-3-13(6-8)7-11-9-4-12-5-10(9)11/h8-12,14H,1-7H2
InChIKeyUFERRJWLFWGDJB-UHFFFAOYSA-N
XLogP-0.09
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol?
The IUPAC name of 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol (CID 83818752) is 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol?
The canonical SMILES for 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol is OC1CCCN(CC2C3CNCC32)C1.
What is the InChIKey of 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol?
The InChIKey is UFERRJWLFWGDJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c14-8-2-1-3-13(6-8)7-11-9-4-12-5-10(9)11/h8-12,14H,1-7H2.
What are the key properties of 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol?
1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol has a molecular weight of 196.29 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 83818752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).