1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane

C11H19F — CID 134228536

IUPAC1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane
SMILESCCC1C(C)C(F)CC1C1CC1
InChIInChI=1S/C11H19F/c1-3-9-7(2)11(12)6-10(9)8-4-5-8/h7-11H,3-6H2,1-2H3
InChIKeyFYAODQBIAZAXND-UHFFFAOYSA-N
MW170.27 g/mol
LogP3.42
Rot. Bonds2

About 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane

1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane (PubChem CID 134228536) has the molecular formula C11H19F and a molecular weight of 170.27 g/mol. Its IUPAC name is 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane.

Molecular Properties

Compound Name1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane
PubChem CID134228536
Molecular FormulaC11H19F
Molecular Weight170.27 g/mol
Exact Mass170.15
IUPAC Name1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane
SMILESCCC1C(C)C(F)CC1C1CC1
InChIInChI=1S/C11H19F/c1-3-9-7(2)11(12)6-10(9)8-4-5-8/h7-11H,3-6H2,1-2H3
InChIKeyFYAODQBIAZAXND-UHFFFAOYSA-N
XLogP3.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.27
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(7S)-7-ethyl-2-methylbicyclo[2.2.1]heptane
CID 144532112
(3R,5R,6S)-2-ethyl-3,5,6-trimethylbicyclo[2.2.1]heptane
CID 159924784
5-ethyl-6-methylbicyclo[2.1.1]hexane
CID 123324829
(1R,2R,3S,4S)-2-[2-[(1S,2S,3R,4R)-3-ethyl-2-bicyclo[2.2.1]heptanyl]ethyl]-3-[2-[(1R,2R,3S,4S)-3-methyl-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 59960440
2-ethyl-3-methylbicyclo[5.1.0]octane
CID 123245029
2,7-diethylbicyclo[2.2.1]heptane
CID 146718976
1,3-difluoro-2-methyl-5-[4-[4-(4-methylcyclohexyl)cyclohexyl]cyclohexyl]cyclohexane
CID 122534276
1-ethyl-2,3,4-trimethyl-2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalene
CID 162289049
(1R,2R)-3-cyclopropyl-2-methylbicyclo[3.1.0]hexane
CID 163692624
2-ethyltricyclo[3.2.1.03,8]octane
CID 123682557
4-(4-butylcyclohexyl)-2-fluoro-1-(4-methylcyclohexyl)cyclohexane
CID 70911437
(4aR,8aS)-3-ethyl-2-methyl-2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalene
CID 162292694

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane?
The IUPAC name of 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane (CID 134228536) is 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane.
What is the SMILES notation for 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane?
The canonical SMILES for 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane is CCC1C(C)C(F)CC1C1CC1.
What is the InChIKey of 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane?
The InChIKey is FYAODQBIAZAXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F/c1-3-9-7(2)11(12)6-10(9)8-4-5-8/h7-11H,3-6H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane?
1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane has a molecular weight of 170.27 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-ethyl-4-fluoro-3-methylcyclopentane is sourced from PubChem (CID 134228536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).