1-methoxy-2-(trifluoromethyl)cyclopentane

C7H11F3O — CID 167481694

IUPAC1-methoxy-2-(trifluoromethyl)cyclopentane
SMILESCOC1CCCC1C(F)(F)F
InChIInChI=1S/C7H11F3O/c1-11-6-4-2-3-5(6)7(8,9)10/h5-6H,2-4H2,1H3
InChIKeyQPOWWCDVGJKHRI-UHFFFAOYSA-N
MW168.16 g/mol
LogP2.36
Rot. Bonds1

About 1-methoxy-2-(trifluoromethyl)cyclopentane

1-methoxy-2-(trifluoromethyl)cyclopentane (PubChem CID 167481694) has the molecular formula C7H11F3O and a molecular weight of 168.16 g/mol. Its IUPAC name is 1-methoxy-2-(trifluoromethyl)cyclopentane.

Molecular Properties

Compound Name1-methoxy-2-(trifluoromethyl)cyclopentane
PubChem CID167481694
Molecular FormulaC7H11F3O
Molecular Weight168.16 g/mol
Exact Mass168.08
IUPAC Name1-methoxy-2-(trifluoromethyl)cyclopentane
SMILESCOC1CCCC1C(F)(F)F
InChIInChI=1S/C7H11F3O/c1-11-6-4-2-3-5(6)7(8,9)10/h5-6H,2-4H2,1H3
InChIKeyQPOWWCDVGJKHRI-UHFFFAOYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-(trifluoromethyl)cyclopentane?
The IUPAC name of 1-methoxy-2-(trifluoromethyl)cyclopentane (CID 167481694) is 1-methoxy-2-(trifluoromethyl)cyclopentane.
What is the SMILES notation for 1-methoxy-2-(trifluoromethyl)cyclopentane?
The canonical SMILES for 1-methoxy-2-(trifluoromethyl)cyclopentane is COC1CCCC1C(F)(F)F.
What is the InChIKey of 1-methoxy-2-(trifluoromethyl)cyclopentane?
The InChIKey is QPOWWCDVGJKHRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O/c1-11-6-4-2-3-5(6)7(8,9)10/h5-6H,2-4H2,1H3.
What are the key properties of 1-methoxy-2-(trifluoromethyl)cyclopentane?
1-methoxy-2-(trifluoromethyl)cyclopentane has a molecular weight of 168.16 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(trifluoromethyl)cyclopentane is sourced from PubChem (CID 167481694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).