[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol

C6H11NO — CID 15713442

IUPAC[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
SMILESOCC1[C@H]2CNC[C@@H]12
InChIInChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2/t4-,5+,6?
InChIKeyYGYOQZPGFXHQMW-XEAPYIEGSA-N
MW113.16 g/mol
LogP-0.56
Rot. Bonds1

About [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol

[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol (PubChem CID 15713442) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol.

Molecular Properties

Compound Name[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
PubChem CID15713442
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
SMILESOCC1[C@H]2CNC[C@@H]12
InChIInChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2/t4-,5+,6?
InChIKeyYGYOQZPGFXHQMW-XEAPYIEGSA-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

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Frequently Asked Questions

What is the IUPAC name of [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The IUPAC name of [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol (CID 15713442) is [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol.
What is the SMILES notation for [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The canonical SMILES for [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol is OCC1[C@H]2CNC[C@@H]12.
What is the InChIKey of [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The InChIKey is YGYOQZPGFXHQMW-XEAPYIEGSA-N. The full InChI is InChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2/t4-,5+,6?.
What are the key properties of [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol 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 [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol is sourced from PubChem (CID 15713442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).