2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol

C11H18F3NO — CID 114339068

IUPAC2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCN1CC(F)(F)F
InChIInChI=1S/C11H18F3NO/c12-11(13,14)7-15-6-2-4-9(15)8-3-1-5-10(8)16/h8-10,16H,1-7H2
InChIKeyKYOKOSFEDGZDIQ-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.17
Rot. Bonds2

About 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol

2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol (PubChem CID 114339068) has the molecular formula C11H18F3NO and a molecular weight of 237.26 g/mol. Its IUPAC name is 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol
PubChem CID114339068
Molecular FormulaC11H18F3NO
Molecular Weight237.26 g/mol
Exact Mass237.13
IUPAC Name2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCN1CC(F)(F)F
InChIInChI=1S/C11H18F3NO/c12-11(13,14)7-15-6-2-4-9(15)8-3-1-5-10(8)16/h8-10,16H,1-7H2
InChIKeyKYOKOSFEDGZDIQ-UHFFFAOYSA-N
XLogP2.17
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The IUPAC name of 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol (CID 114339068) is 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol is OC1CCCC1C1CCCN1CC(F)(F)F.
What is the InChIKey of 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol?
The InChIKey is KYOKOSFEDGZDIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3NO/c12-11(13,14)7-15-6-2-4-9(15)8-3-1-5-10(8)16/h8-10,16H,1-7H2.
What are the key properties of 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol?
2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol has a molecular weight of 237.26 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol is sourced from PubChem (CID 114339068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).