trifluoromethylcyclopentane

C6H9F3 — CID 18520895

IUPACtrifluoromethylcyclopentane
SMILESFC(F)(F)C1CCCC1
InChIInChI=1S/C6H9F3/c7-6(8,9)5-3-1-2-4-5/h5H,1-4H2
InChIKeyOCEBOBGSOQRMQZ-UHFFFAOYSA-N
MW138.13 g/mol
LogP2.74
Rot. Bonds

About trifluoromethylcyclopentane

trifluoromethylcyclopentane (PubChem CID 18520895) has the molecular formula C6H9F3 and a molecular weight of 138.13 g/mol. Its IUPAC name is trifluoromethylcyclopentane.

Molecular Properties

Compound Nametrifluoromethylcyclopentane
PubChem CID18520895
Molecular FormulaC6H9F3
Molecular Weight138.13 g/mol
Exact Mass138.07
IUPAC Nametrifluoromethylcyclopentane
SMILESFC(F)(F)C1CCCC1
InChIInChI=1S/C6H9F3/c7-6(8,9)5-3-1-2-4-5/h5H,1-4H2
InChIKeyOCEBOBGSOQRMQZ-UHFFFAOYSA-N
XLogP2.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.13
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of trifluoromethylcyclopentane?
The IUPAC name of trifluoromethylcyclopentane (CID 18520895) is trifluoromethylcyclopentane.
What is the SMILES notation for trifluoromethylcyclopentane?
The canonical SMILES for trifluoromethylcyclopentane is FC(F)(F)C1CCCC1.
What is the InChIKey of trifluoromethylcyclopentane?
The InChIKey is OCEBOBGSOQRMQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3/c7-6(8,9)5-3-1-2-4-5/h5H,1-4H2.
What are the key properties of trifluoromethylcyclopentane?
trifluoromethylcyclopentane has a molecular weight of 138.13 g/mol, XLogP of 2.74, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoromethylcyclopentane is sourced from PubChem (CID 18520895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).