2,5-diethyl-1,1-difluorocyclopentane

C9H16F2 — CID 20771103

IUPAC2,5-diethyl-1,1-difluorocyclopentane
SMILESCCC1CCC(CC)C1(F)F
InChIInChI=1S/C9H16F2/c1-3-7-5-6-8(4-2)9(7,10)11/h7-8H,3-6H2,1-2H3
InChIKeyFKBWEFHGELIDDB-UHFFFAOYSA-N
MW162.22 g/mol
LogP3.47
Rot. Bonds2

About 2,5-diethyl-1,1-difluorocyclopentane

2,5-diethyl-1,1-difluorocyclopentane (PubChem CID 20771103) has the molecular formula C9H16F2 and a molecular weight of 162.22 g/mol. Its IUPAC name is 2,5-diethyl-1,1-difluorocyclopentane.

Molecular Properties

Compound Name2,5-diethyl-1,1-difluorocyclopentane
PubChem CID20771103
Molecular FormulaC9H16F2
Molecular Weight162.22 g/mol
Exact Mass162.12
IUPAC Name2,5-diethyl-1,1-difluorocyclopentane
SMILESCCC1CCC(CC)C1(F)F
InChIInChI=1S/C9H16F2/c1-3-7-5-6-8(4-2)9(7,10)11/h7-8H,3-6H2,1-2H3
InChIKeyFKBWEFHGELIDDB-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.22
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-cis-3-Methylpropylcyclopentane
CID 6427086
trans-1-Methyl-3-propylcyclopentane
CID 20837636
1-Hexyl-3-methylcyclopentane
CID 544055
1-Isobutyl-3-methylcyclopentane
CID 520404
1-Butyl-3-methylcyclopentane
CID 523489
1,3-Diethylcyclopentane
CID 530396
1,3-Diethylcyclopentane, cis
CID 6431020
trans-1,3-Diethylcyclopentane
CID 6537508
4-(Difluoromethyl)octane
CID 14909954
trans-(1R,3R)-1-tert-butyl-3-(1,1-difluoroethyl)cyclopentane
CID 15402166
Potassium 1,3-bis(3,3,3-trifluoropropyl)cyclopentane
CID 134993603
2,2-Difluoroethylcyclododecane
CID 166446773

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-1,1-difluorocyclopentane?
The IUPAC name of 2,5-diethyl-1,1-difluorocyclopentane (CID 20771103) is 2,5-diethyl-1,1-difluorocyclopentane.
What is the SMILES notation for 2,5-diethyl-1,1-difluorocyclopentane?
The canonical SMILES for 2,5-diethyl-1,1-difluorocyclopentane is CCC1CCC(CC)C1(F)F.
What is the InChIKey of 2,5-diethyl-1,1-difluorocyclopentane?
The InChIKey is FKBWEFHGELIDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2/c1-3-7-5-6-8(4-2)9(7,10)11/h7-8H,3-6H2,1-2H3.
What are the key properties of 2,5-diethyl-1,1-difluorocyclopentane?
2,5-diethyl-1,1-difluorocyclopentane has a molecular weight of 162.22 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-1,1-difluorocyclopentane is sourced from PubChem (CID 20771103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).