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

C10H16FNO — CID 130658462

IUPAC[(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol
SMILESOCC1[C@H]2CN(CC3(F)CC3)C[C@@H]12
InChIInChI=1S/C10H16FNO/c11-10(1-2-10)6-12-3-7-8(4-12)9(7)5-13/h7-9,13H,1-6H2/t7-,8+,9?
InChIKeyKNGBVMZPKFMMDE-JVHMLUBASA-N
MW185.24 g/mol
LogP0.66
Rot. Bonds3

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

[(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol (PubChem CID 130658462) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol.

Molecular Properties

Compound Name[(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol
PubChem CID130658462
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name[(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol
SMILESOCC1[C@H]2CN(CC3(F)CC3)C[C@@H]12
InChIInChI=1S/C10H16FNO/c11-10(1-2-10)6-12-3-7-8(4-12)9(7)5-13/h7-9,13H,1-6H2/t7-,8+,9?
InChIKeyKNGBVMZPKFMMDE-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

Analyze [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol with MolForge

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Related Compounds

{3-Methyl-3-azabicyclo[3.1.0]hexan-6-yl}methanol
CID 67269927
[(1R,5S,6R)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 59540724
[(1R,5S)-3-(2,2,2-trifluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 131061530
[3-(2,2,2-Trifluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 167468149
[1-[(6-Fluoro-3-azabicyclo[3.1.0]hexan-3-yl)methyl]cyclopropyl]methanol
CID 178065523
2-(1-Ethylpyrrolidin-3-yl)-2-fluoroethanol
CID 105431671
2-[1-(2-Fluoroethyl)pyrrolidin-3-yl]ethanol
CID 115694999
2-[1-(3-Fluoropropyl)pyrrolidin-3-yl]ethanol
CID 115721403
[(1R,5S)-3-(2,2-difluoroethyl)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 130653702
[1-[[(1S,5R)-6-fluoro-3-azabicyclo[3.1.0]hexan-3-yl]methyl]cyclopropyl]methanol
CID 178037951
(3-Prop-2-ynyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol
CID 18616806
[(1S,5R)-3-(2,2-dimethylpropyl)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 59848795

Frequently Asked Questions

What is the IUPAC name of [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The IUPAC name of [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol (CID 130658462) is [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol.
What is the SMILES notation for [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The canonical SMILES for [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol is OCC1[C@H]2CN(CC3(F)CC3)C[C@@H]12.
What is the InChIKey of [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The InChIKey is KNGBVMZPKFMMDE-JVHMLUBASA-N. The full InChI is InChI=1S/C10H16FNO/c11-10(1-2-10)6-12-3-7-8(4-12)9(7)5-13/h7-9,13H,1-6H2/t7-,8+,9?.
What are the key properties of [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
[(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]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 [(1S,5R)-3-[(1-fluorocyclopropyl)methyl]-3-azabicyclo[3.1.0]hexan-6-yl]methanol is sourced from PubChem (CID 130658462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).