(1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide

C11H18FNO — CID 11816471

IUPAC(1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide
SMILESC[C@@]12CCC[C@@H]([C@H]1F)[C@](C)(C(N)=O)C2
InChIInChI=1S/C11H18FNO/c1-10-5-3-4-7(8(10)12)11(2,6-10)9(13)14/h7-8H,3-6H2,1-2H3,(H2,13,14)/t7-,8+,10-,11+/m0/s1
InChIKeyANIMCUAYEVKTFT-GISOBZBCSA-N
MW199.27 g/mol
LogP2.03
Rot. Bonds1

About (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide

(1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide (PubChem CID 11816471) has the molecular formula C11H18FNO and a molecular weight of 199.27 g/mol. Its IUPAC name is (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide.

Molecular Properties

Compound Name(1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide
PubChem CID11816471
Molecular FormulaC11H18FNO
Molecular Weight199.27 g/mol
Exact Mass199.14
IUPAC Name(1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide
SMILESC[C@@]12CCC[C@@H]([C@H]1F)[C@](C)(C(N)=O)C2
InChIInChI=1S/C11H18FNO/c1-10-5-3-4-7(8(10)12)11(2,6-10)9(13)14/h7-8H,3-6H2,1-2H3,(H2,13,14)/t7-,8+,10-,11+/m0/s1
InChIKeyANIMCUAYEVKTFT-GISOBZBCSA-N
XLogP2.03
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.27
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide 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 (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
The IUPAC name of (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide (CID 11816471) is (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide.
What is the SMILES notation for (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
The canonical SMILES for (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide is C[C@@]12CCC[C@@H]([C@H]1F)[C@](C)(C(N)=O)C2.
What is the InChIKey of (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
The InChIKey is ANIMCUAYEVKTFT-GISOBZBCSA-N. The full InChI is InChI=1S/C11H18FNO/c1-10-5-3-4-7(8(10)12)11(2,6-10)9(13)14/h7-8H,3-6H2,1-2H3,(H2,13,14)/t7-,8+,10-,11+/m0/s1.
What are the key properties of (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
(1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide has a molecular weight of 199.27 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5R,6R,8R)-8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide is sourced from PubChem (CID 11816471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).