2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol

C12H20F3NO2 — CID 114339297

IUPAC2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCN1CCOC(F)(F)F
InChIInChI=1S/C12H20F3NO2/c13-12(14,15)18-8-7-16-6-2-4-10(16)9-3-1-5-11(9)17/h9-11,17H,1-8H2
InChIKeyDTLSAFWZRZVYGT-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.15
Rot. Bonds4

About 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol

2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol (PubChem CID 114339297) has the molecular formula C12H20F3NO2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol
PubChem CID114339297
Molecular FormulaC12H20F3NO2
Molecular Weight267.29 g/mol
Exact Mass267.14
IUPAC Name2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol
SMILESOC1CCCC1C1CCCN1CCOC(F)(F)F
InChIInChI=1S/C12H20F3NO2/c13-12(14,15)18-8-7-16-6-2-4-10(16)9-3-1-5-11(9)17/h9-11,17H,1-8H2
InChIKeyDTLSAFWZRZVYGT-UHFFFAOYSA-N
XLogP2.15
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Cyclopentyl-4,4-difluoro-3-hydroxypyrrolidine-1-carbaldehyde
CID 175542192
4,4,4-Trifluoro-1-(1-pyrrolidin-1-ylcyclopentyl)butan-1-ol
CID 79057691
1-Cyclopentyl-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]propan-2-ol
CID 103159927
1-[2-(2-Hydroxycyclopentyl)pyrrolidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 103209220
1-Cyclopentyl-3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]propan-2-ol
CID 107483874
2-[1-(4,4,4-Trifluorobutyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 113569247
2-[1-(3,3,3-Trifluoro-2-hydroxypropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 113569259
1-Cyclopentyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propan-2-ol
CID 113964848
2-[1-(3,3,3-Trifluoropropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339029
2-[1-(2,2,2-Trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339068
2-[1-(2,2-Difluoroethyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339091
2-[1-(3-Fluoropropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339113

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol?
The IUPAC name of 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol (CID 114339297) is 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol is OC1CCCC1C1CCCN1CCOC(F)(F)F.
What is the InChIKey of 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol?
The InChIKey is DTLSAFWZRZVYGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F3NO2/c13-12(14,15)18-8-7-16-6-2-4-10(16)9-3-1-5-11(9)17/h9-11,17H,1-8H2.
What are the key properties of 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol?
2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol has a molecular weight of 267.29 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(trifluoromethoxy)ethyl]pyrrolidin-2-yl]cyclopentan-1-ol is sourced from PubChem (CID 114339297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).