2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol

C8H14F3NO — CID 63226872

IUPAC2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol
SMILESOC1CCCC1NCCC(F)(F)F
InChIInChI=1S/C8H14F3NO/c9-8(10,11)4-5-12-6-2-1-3-7(6)13/h6-7,12-13H,1-5H2
InChIKeyZREBVZBSCIYYID-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.44
Rot. Bonds3

About 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol

2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol (PubChem CID 63226872) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol
PubChem CID63226872
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol
SMILESOC1CCCC1NCCC(F)(F)F
InChIInChI=1S/C8H14F3NO/c9-8(10,11)4-5-12-6-2-1-3-7(6)13/h6-7,12-13H,1-5H2
InChIKeyZREBVZBSCIYYID-UHFFFAOYSA-N
XLogP1.44
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol?
The IUPAC name of 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol (CID 63226872) is 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol.
What is the SMILES notation for 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol?
The canonical SMILES for 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol is OC1CCCC1NCCC(F)(F)F.
What is the InChIKey of 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol?
The InChIKey is ZREBVZBSCIYYID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c9-8(10,11)4-5-12-6-2-1-3-7(6)13/h6-7,12-13H,1-5H2.
What are the key properties of 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol?
2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol has a molecular weight of 197.20 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol is sourced from PubChem (CID 63226872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).