(1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane

C13H25F — CID 166923808

IUPAC(1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane
SMILESCC(C)CC1CCC(C)CCC[C@H]1F
InChIInChI=1S/C13H25F/c1-10(2)9-12-8-7-11(3)5-4-6-13(12)14/h10-13H,4-9H2,1-3H3/t11?,12?,13-/m1/s1
InChIKeyPWMXHUNKCDJPLR-WXRRBKDZSA-N
MW200.34 g/mol
LogP4.59
Rot. Bonds2

About (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane

(1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane (PubChem CID 166923808) has the molecular formula C13H25F and a molecular weight of 200.34 g/mol. Its IUPAC name is (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane.

Molecular Properties

Compound Name(1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane
PubChem CID166923808
Molecular FormulaC13H25F
Molecular Weight200.34 g/mol
Exact Mass200.19
IUPAC Name(1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane
SMILESCC(C)CC1CCC(C)CCC[C@H]1F
InChIInChI=1S/C13H25F/c1-10(2)9-12-8-7-11(3)5-4-6-13(12)14/h10-13H,4-9H2,1-3H3/t11?,12?,13-/m1/s1
InChIKeyPWMXHUNKCDJPLR-WXRRBKDZSA-N
XLogP4.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.34
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-fluorocyclohexyl)propan-2-ol
CID 89165840
(1S)-1-methyl-3-(2-methylpropyl)cyclohexane
CID 140722932
2-methylbutane;methylcyclobutane
CID 57473841
(1R,2R,4R)-1,4-dimethyl-2-(2-methylpropyl)cyclohexane
CID 55253031
1,5,9,13,17,21-hexamethylcyclotetracosane
CID 164675975
(1R)-1-fluoro-4-methylcycloheptane
CID 155056751
butane;methylcyclobutane;methylcyclopropane;2-methylpropane;propane
CID 160734051
1,2-bis(2-methylpropyl)cycloheptane
CID 175310859
4-(2,3-dimethylbutyl)-1,7-dimethylcyclodecane
CID 123783398
4-methyl-2-(2-methylpropyl)cyclohexan-1-amine
CID 55134788
cyclohexane;cyclopentane;ethylcyclopropane;methanol;2-methylbutane;methylcyclobutane;methylcyclopentane;methylcyclopropane
CID 174801862
3-(2-fluorocyclohexyl)-2-methylpropanoic acid
CID 84732893

Frequently Asked Questions

What is the IUPAC name of (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane?
The IUPAC name of (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane (CID 166923808) is (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane.
What is the SMILES notation for (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane?
The canonical SMILES for (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane is CC(C)CC1CCC(C)CCC[C@H]1F.
What is the InChIKey of (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane?
The InChIKey is PWMXHUNKCDJPLR-WXRRBKDZSA-N. The full InChI is InChI=1S/C13H25F/c1-10(2)9-12-8-7-11(3)5-4-6-13(12)14/h10-13H,4-9H2,1-3H3/t11?,12?,13-/m1/s1.
What are the key properties of (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane?
(1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane has a molecular weight of 200.34 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-fluoro-5-methyl-2-(2-methylpropyl)cyclooctane is sourced from PubChem (CID 166923808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).