3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine

C10H17F3N2 — CID 175318874

IUPAC3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine
SMILESFC(F)(F)CN1CCC(N2CCCC2)C1
InChIInChI=1S/C10H17F3N2/c11-10(12,13)8-14-6-3-9(7-14)15-4-1-2-5-15/h9H,1-8H2
InChIKeyBPDBWBZNJHVNDL-UHFFFAOYSA-N
MW222.25 g/mol
LogP1.72
Rot. Bonds2

About 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine

3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine (PubChem CID 175318874) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine.

Molecular Properties

Compound Name3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine
PubChem CID175318874
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC Name3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine
SMILESFC(F)(F)CN1CCC(N2CCCC2)C1
InChIInChI=1S/C10H17F3N2/c11-10(12,13)8-14-6-3-9(7-14)15-4-1-2-5-15/h9H,1-8H2
InChIKeyBPDBWBZNJHVNDL-UHFFFAOYSA-N
XLogP1.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-pyrrolidin-1-yl-1-(2,2,3,3-tetrafluoropropyl)piperidine
CID 95634847
2-methyl-2-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]butanal
CID 55158758
2-amino-2-methyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanenitrile
CID 63165465
N-tert-butyl-2,2-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-1-amine
CID 63168780
2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
CID 45157083
N,3,3-trimethyl-4-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-amine
CID 66453022
(3S)-3-methyl-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 122495210
1-[1-(2-chloroethyl)pyrrolidin-3-yl]piperidine
CID 63171000
3,3,3-trifluoro-N'-hydroxy-2-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]propanimidamide
CID 103369423
N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide
CID 126795613
(7aS)-2-[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione
CID 124918139
1-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63170952

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine?
The IUPAC name of 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine (CID 175318874) is 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine.
What is the SMILES notation for 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine?
The canonical SMILES for 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine is FC(F)(F)CN1CCC(N2CCCC2)C1.
What is the InChIKey of 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine?
The InChIKey is BPDBWBZNJHVNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2/c11-10(12,13)8-14-6-3-9(7-14)15-4-1-2-5-15/h9H,1-8H2.
What are the key properties of 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine?
3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine has a molecular weight of 222.25 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-1-yl-1-(2,2,2-trifluoroethyl)pyrrolidine is sourced from PubChem (CID 175318874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).