3-(trifluoromethoxy)cyclopentan-1-amine

C6H10F3NO — CID 131003819

IUPAC3-(trifluoromethoxy)cyclopentan-1-amine
SMILESNC1CCC(OC(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)11-5-2-1-4(10)3-5/h4-5H,1-3,10H2
InChIKeyPNPKBKBHPYUXOM-UHFFFAOYSA-N
MW169.15 g/mol
LogP1.40
Rot. Bonds1

About 3-(trifluoromethoxy)cyclopentan-1-amine

3-(trifluoromethoxy)cyclopentan-1-amine (PubChem CID 131003819) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 3-(trifluoromethoxy)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(trifluoromethoxy)cyclopentan-1-amine
PubChem CID131003819
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name3-(trifluoromethoxy)cyclopentan-1-amine
SMILESNC1CCC(OC(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)11-5-2-1-4(10)3-5/h4-5H,1-3,10H2
InChIKeyPNPKBKBHPYUXOM-UHFFFAOYSA-N
XLogP1.40
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethoxy)cyclopentan-1-amine?
The IUPAC name of 3-(trifluoromethoxy)cyclopentan-1-amine (CID 131003819) is 3-(trifluoromethoxy)cyclopentan-1-amine.
What is the SMILES notation for 3-(trifluoromethoxy)cyclopentan-1-amine?
The canonical SMILES for 3-(trifluoromethoxy)cyclopentan-1-amine is NC1CCC(OC(F)(F)F)C1.
What is the InChIKey of 3-(trifluoromethoxy)cyclopentan-1-amine?
The InChIKey is PNPKBKBHPYUXOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)11-5-2-1-4(10)3-5/h4-5H,1-3,10H2.
What are the key properties of 3-(trifluoromethoxy)cyclopentan-1-amine?
3-(trifluoromethoxy)cyclopentan-1-amine has a molecular weight of 169.15 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethoxy)cyclopentan-1-amine is sourced from PubChem (CID 131003819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).