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

C10H16FNO — CID 178037951

IUPAC[1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol
SMILESOCC1(CN2C[C@@H]3C(F)[C@@H]3C2)CC1
InChIInChI=1S/C10H16FNO/c11-9-7-3-12(4-8(7)9)5-10(6-13)1-2-10/h7-9,13H,1-6H2/t7-,8+,9?
InChIKeyHWIBJLJSEOGQEH-JVHMLUBASA-N
MW185.24 g/mol
LogP0.66
Rot. Bonds3

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

[1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol (PubChem CID 178037951) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol
PubChem CID178037951
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name[1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol
SMILESOCC1(CN2C[C@@H]3C(F)[C@@H]3C2)CC1
InChIInChI=1S/C10H16FNO/c11-9-7-3-12(4-8(7)9)5-10(6-13)1-2-10/h7-9,13H,1-6H2/t7-,8+,9?
InChIKeyHWIBJLJSEOGQEH-JVHMLUBASA-N
XLogP0.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol (CID 178037951) is [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol is OCC1(CN2C[C@@H]3C(F)[C@@H]3C2)CC1.
What is the InChIKey of [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol?
The InChIKey is HWIBJLJSEOGQEH-JVHMLUBASA-N. The full InChI is InChI=1S/C10H16FNO/c11-9-7-3-12(4-8(7)9)5-10(6-13)1-2-10/h7-9,13H,1-6H2/t7-,8+,9?.
What are the key properties of [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol?
[1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol has a molecular weight of 185.24 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol is sourced from PubChem (CID 178037951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).