3-cyclopentyl-1,1-difluoropropan-2-ol

C8H14F2O — CID 112575466

IUPAC3-cyclopentyl-1,1-difluoropropan-2-ol
SMILESOC(CC1CCCC1)C(F)F
InChIInChI=1S/C8H14F2O/c9-8(10)7(11)5-6-3-1-2-4-6/h6-8,11H,1-5H2
InChIKeyZICREABVDJBIDK-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.19
Rot. Bonds3

About 3-cyclopentyl-1,1-difluoropropan-2-ol

3-cyclopentyl-1,1-difluoropropan-2-ol (PubChem CID 112575466) has the molecular formula C8H14F2O and a molecular weight of 164.20 g/mol. Its IUPAC name is 3-cyclopentyl-1,1-difluoropropan-2-ol.

Molecular Properties

Compound Name3-cyclopentyl-1,1-difluoropropan-2-ol
PubChem CID112575466
Molecular FormulaC8H14F2O
Molecular Weight164.20 g/mol
Exact Mass164.10
IUPAC Name3-cyclopentyl-1,1-difluoropropan-2-ol
SMILESOC(CC1CCCC1)C(F)F
InChIInChI=1S/C8H14F2O/c9-8(10)7(11)5-6-3-1-2-4-6/h6-8,11H,1-5H2
InChIKeyZICREABVDJBIDK-UHFFFAOYSA-N
XLogP2.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-3-cyclopentyl-2-fluoropropan-1-ol
CID 129375583
3-(1-cyclobutylpropan-2-ylamino)-1,1-difluoropropan-2-ol
CID 103787931
2-cyclopentyl-1-[4-(difluoromethyl)phenyl]ethanol
CID 115525070
3-cyclohexyl-1,1-difluoro-N-methylpropan-2-amine
CID 80604795
(2R)-1-cyclohexylbutan-2-ol
CID 59949714
(2S,4R)-2,4-diamino-1,5-dicyclohexylpentan-3-ol
CID 10636664
4-amino-5-cyclohexyl-1-(2,3,3-trifluoropropylamino)pentane-2,3-diol
CID 70048103
(2S,3R)-3-amino-1-cyclobutylbutan-2-ol
CID 124673545
(3R,4S)-4-amino-5-cyclohexylpentane-1,2,3-triol
CID 57086179
(2R)-3-cyclopentyl-2-fluoro-N-methylpropan-1-amine
CID 129462680
1-cyclohexylpent-4-en-2-ol
CID 13166988
1-cyclobutyl-3-methylpentan-2-ol
CID 65459256

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1,1-difluoropropan-2-ol?
The IUPAC name of 3-cyclopentyl-1,1-difluoropropan-2-ol (CID 112575466) is 3-cyclopentyl-1,1-difluoropropan-2-ol.
What is the SMILES notation for 3-cyclopentyl-1,1-difluoropropan-2-ol?
The canonical SMILES for 3-cyclopentyl-1,1-difluoropropan-2-ol is OC(CC1CCCC1)C(F)F.
What is the InChIKey of 3-cyclopentyl-1,1-difluoropropan-2-ol?
The InChIKey is ZICREABVDJBIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O/c9-8(10)7(11)5-6-3-1-2-4-6/h6-8,11H,1-5H2.
What are the key properties of 3-cyclopentyl-1,1-difluoropropan-2-ol?
3-cyclopentyl-1,1-difluoropropan-2-ol has a molecular weight of 164.20 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1,1-difluoropropan-2-ol is sourced from PubChem (CID 112575466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).