6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol

C6H10FNO — CID 171036694

IUPAC6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol
SMILESCN1CC2C(O)C1C2F
InChIInChI=1S/C6H10FNO/c1-8-2-3-4(7)5(8)6(3)9/h3-6,9H,2H2,1H3
InChIKeyHFTCCSJPHUPLQL-UHFFFAOYSA-N
MW131.15 g/mol
LogP-0.37
Rot. Bonds

About 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol

6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol (PubChem CID 171036694) has the molecular formula C6H10FNO and a molecular weight of 131.15 g/mol. Its IUPAC name is 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol.

Molecular Properties

Compound Name6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol
PubChem CID171036694
Molecular FormulaC6H10FNO
Molecular Weight131.15 g/mol
Exact Mass131.07
IUPAC Name6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol
SMILESCN1CC2C(O)C1C2F
InChIInChI=1S/C6H10FNO/c1-8-2-3-4(7)5(8)6(3)9/h3-6,9H,2H2,1H3
InChIKeyHFTCCSJPHUPLQL-UHFFFAOYSA-N
XLogP-0.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.15
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol 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 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol?
The IUPAC name of 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol (CID 171036694) is 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol.
What is the SMILES notation for 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol?
The canonical SMILES for 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol is CN1CC2C(O)C1C2F.
What is the InChIKey of 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol?
The InChIKey is HFTCCSJPHUPLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FNO/c1-8-2-3-4(7)5(8)6(3)9/h3-6,9H,2H2,1H3.
What are the key properties of 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol?
6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol has a molecular weight of 131.15 g/mol, XLogP of -0.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-2-azabicyclo[2.1.1]hexan-5-ol is sourced from PubChem (CID 171036694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).