(1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane

C8H14FN — CID 141150291

IUPAC(1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane
SMILESCN1[C@@H]2CCC[C@@]1(F)CC2
InChIInChI=1S/C8H14FN/c1-10-7-3-2-5-8(10,9)6-4-7/h7H,2-6H2,1H3/t7-,8+/m1/s1
InChIKeySKQGYVVSNIKYTF-SFYZADRCSA-N
MW143.21 g/mol
LogP1.93
Rot. Bonds

About (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane

(1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane (PubChem CID 141150291) has the molecular formula C8H14FN and a molecular weight of 143.21 g/mol. Its IUPAC name is (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name(1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane
PubChem CID141150291
Molecular FormulaC8H14FN
Molecular Weight143.21 g/mol
Exact Mass143.11
IUPAC Name(1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane
SMILESCN1[C@@H]2CCC[C@@]1(F)CC2
InChIInChI=1S/C8H14FN/c1-10-7-3-2-5-8(10,9)6-4-7/h7H,2-6H2,1H3/t7-,8+/m1/s1
InChIKeySKQGYVVSNIKYTF-SFYZADRCSA-N
XLogP1.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane 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 (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane?
The IUPAC name of (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane (CID 141150291) is (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane?
The canonical SMILES for (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane is CN1[C@@H]2CCC[C@@]1(F)CC2.
What is the InChIKey of (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane?
The InChIKey is SKQGYVVSNIKYTF-SFYZADRCSA-N. The full InChI is InChI=1S/C8H14FN/c1-10-7-3-2-5-8(10,9)6-4-7/h7H,2-6H2,1H3/t7-,8+/m1/s1.
What are the key properties of (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane?
(1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane has a molecular weight of 143.21 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5R)-1-fluoro-8-methyl-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 141150291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).