(3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone

C10H12F2O2 — CID 130484849

IUPAC(3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone
SMILESO=C(C1=CCCO1)C1CCC(F)(F)C1
InChIInChI=1S/C10H12F2O2/c11-10(12)4-3-7(6-10)9(13)8-2-1-5-14-8/h2,7H,1,3-6H2
InChIKeyPRLGCDCJLQADNN-UHFFFAOYSA-N
MW202.20 g/mol
LogP2.30
Rot. Bonds2

About (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone

(3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone (PubChem CID 130484849) has the molecular formula C10H12F2O2 and a molecular weight of 202.20 g/mol. Its IUPAC name is (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone.

Molecular Properties

Compound Name(3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone
PubChem CID130484849
Molecular FormulaC10H12F2O2
Molecular Weight202.20 g/mol
Exact Mass202.08
IUPAC Name(3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone
SMILESO=C(C1=CCCO1)C1CCC(F)(F)C1
InChIInChI=1S/C10H12F2O2/c11-10(12)4-3-7(6-10)9(13)8-2-1-5-14-8/h2,7H,1,3-6H2
InChIKeyPRLGCDCJLQADNN-UHFFFAOYSA-N
XLogP2.30
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4,4-difluorocyclohexyl)-(3,4-dihydro-2H-pyran-6-yl)methanone
CID 102648736
2,3-Dihydrofuran-5-yl-[2-(trifluoromethyl)cyclohexyl]methanone
CID 102652747
2,3-Dihydrofuran-5-yl-[4-(trifluoromethyl)cyclohexyl]methanone
CID 102652786
2,3-Dihydrofuran-5-yl-[3-(trifluoromethyl)cyclohexyl]methanone
CID 102652806
(4,4-Difluorocyclohexyl)-(2,3-dihydrofuran-5-yl)methanone
CID 102652879
(3,3-difluorocyclopentyl)-(3,4-dihydro-2H-pyran-6-yl)methanone
CID 130484861
(3,3-Difluorocyclobutyl)-(2,3-dihydrofuran-5-yl)methanone
CID 130920810
5-Butyl-2-ethoxycyclopent-2-en-1-one
CID 4520162
cyclopentyl(3,4-dihydro-2H-pyran-6-yl)methanone
CID 102646809
2-cyclopentyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanone
CID 102648521
Cyclopentyl(2,3-dihydrofuran-5-yl)methanone
CID 102650876
2,3-Dihydrofuran-5-yl-(3-methylcyclopentyl)methanone
CID 102650981

Frequently Asked Questions

What is the IUPAC name of (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone?
The IUPAC name of (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone (CID 130484849) is (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone.
What is the SMILES notation for (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone?
The canonical SMILES for (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone is O=C(C1=CCCO1)C1CCC(F)(F)C1.
What is the InChIKey of (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone?
The InChIKey is PRLGCDCJLQADNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2O2/c11-10(12)4-3-7(6-10)9(13)8-2-1-5-14-8/h2,7H,1,3-6H2.
What are the key properties of (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone?
(3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone has a molecular weight of 202.20 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-difluorocyclopentyl)-(2,3-dihydrofuran-5-yl)methanone is sourced from PubChem (CID 130484849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).