1-[difluoro(methoxy)methyl]-3-methylcyclopentane

C8H14F2O — CID 18731747

IUPAC1-[difluoro(methoxy)methyl]-3-methylcyclopentane
SMILESCOC(F)(F)C1CCC(C)C1
InChIInChI=1S/C8H14F2O/c1-6-3-4-7(5-6)8(9,10)11-2/h6-7H,3-5H2,1-2H3
InChIKeyFFHSVIDTWGFJFJ-UHFFFAOYSA-N
MW164.19 g/mol
LogP2.66
Rot. Bonds2

About 1-[difluoro(methoxy)methyl]-3-methylcyclopentane

1-[difluoro(methoxy)methyl]-3-methylcyclopentane (PubChem CID 18731747) has the molecular formula C8H14F2O and a molecular weight of 164.19 g/mol. Its IUPAC name is 1-[difluoro(methoxy)methyl]-3-methylcyclopentane.

Molecular Properties

Compound Name1-[difluoro(methoxy)methyl]-3-methylcyclopentane
PubChem CID18731747
Molecular FormulaC8H14F2O
Molecular Weight164.19 g/mol
Exact Mass164.10
IUPAC Name1-[difluoro(methoxy)methyl]-3-methylcyclopentane
SMILESCOC(F)(F)C1CCC(C)C1
InChIInChI=1S/C8H14F2O/c1-6-3-4-7(5-6)8(9,10)11-2/h6-7H,3-5H2,1-2H3
InChIKeyFFHSVIDTWGFJFJ-UHFFFAOYSA-N
XLogP2.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[Ethoxy(difluoro)methyl]cyclopentane
CID 18725580
[Difluoro(methoxy)methyl]cyclopentane
CID 20698411
(1,1-Difluoro-2-methylpropoxy)methylcyclopentane
CID 58422627
1-[Difluoro(methoxy)methyl]-3-fluorocyclopentane
CID 59956178
1,1-Difluoropropoxymethylcyclopentane
CID 68233420
1-[Difluoro(methoxy)methyl]-3-(trifluoromethyl)cyclopentane
CID 71219159
1,1-Difluoroethoxymethylcyclopentane
CID 90392460
1,1-Difluoro-3-(methoxymethyl)cyclopentane
CID 121390808
Ethane;3-(ethoxymethyl)-1,1-difluorocyclopentane
CID 144773823
[Difluoro(methoxy)methyl]cyclopentane;hydrofluoride
CID 157062709
1-[Difluoro(methoxy)methyl]-3-methylcyclopentane;hydrofluoride
CID 157532465
5-Methyl-1-(trifluoromethoxy)hexane
CID 167474087

Frequently Asked Questions

What is the IUPAC name of 1-[difluoro(methoxy)methyl]-3-methylcyclopentane?
The IUPAC name of 1-[difluoro(methoxy)methyl]-3-methylcyclopentane (CID 18731747) is 1-[difluoro(methoxy)methyl]-3-methylcyclopentane.
What is the SMILES notation for 1-[difluoro(methoxy)methyl]-3-methylcyclopentane?
The canonical SMILES for 1-[difluoro(methoxy)methyl]-3-methylcyclopentane is COC(F)(F)C1CCC(C)C1.
What is the InChIKey of 1-[difluoro(methoxy)methyl]-3-methylcyclopentane?
The InChIKey is FFHSVIDTWGFJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O/c1-6-3-4-7(5-6)8(9,10)11-2/h6-7H,3-5H2,1-2H3.
What are the key properties of 1-[difluoro(methoxy)methyl]-3-methylcyclopentane?
1-[difluoro(methoxy)methyl]-3-methylcyclopentane has a molecular weight of 164.19 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[difluoro(methoxy)methyl]-3-methylcyclopentane is sourced from PubChem (CID 18731747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).