8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide

C11H18FNO — CID 73115355

IUPAC8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide
SMILESCC12CCCC(C1F)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)
InChIKeyANIMCUAYEVKTFT-UHFFFAOYSA-N
MW199.27 g/mol
LogP2.03
Rot. Bonds1

About 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide

8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide (PubChem CID 73115355) has the molecular formula C11H18FNO and a molecular weight of 199.27 g/mol. Its IUPAC name is 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide.

Molecular Properties

Compound Name8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide
PubChem CID73115355
Molecular FormulaC11H18FNO
Molecular Weight199.27 g/mol
Exact Mass199.14
IUPAC Name8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide
SMILESCC12CCCC(C1F)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)
InChIKeyANIMCUAYEVKTFT-UHFFFAOYSA-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

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
The IUPAC name of 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide (CID 73115355) is 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide.
What is the SMILES notation for 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
The canonical SMILES for 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide is CC12CCCC(C1F)C(C)(C(N)=O)C2.
What is the InChIKey of 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
The InChIKey is ANIMCUAYEVKTFT-UHFFFAOYSA-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).
What are the key properties of 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide?
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 8-fluoro-1,6-dimethylbicyclo[3.2.1]octane-6-carboxamide is sourced from PubChem (CID 73115355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).