1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine

C13H23F3N2 — CID 126855058

IUPAC1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine
SMILESFC(F)(F)C1CCCN(CCN2CCCCC2)C1
InChIInChI=1S/C13H23F3N2/c14-13(15,16)12-5-4-8-18(11-12)10-9-17-6-2-1-3-7-17/h12H,1-11H2
InChIKeyOHUDYXSPUDOVIR-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.75
Rot. Bonds3

About 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine

1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine (PubChem CID 126855058) has the molecular formula C13H23F3N2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine
PubChem CID126855058
Molecular FormulaC13H23F3N2
Molecular Weight264.33 g/mol
Exact Mass264.18
IUPAC Name1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine
SMILESFC(F)(F)C1CCCN(CCN2CCCCC2)C1
InChIInChI=1S/C13H23F3N2/c14-13(15,16)12-5-4-8-18(11-12)10-9-17-6-2-1-3-7-17/h12H,1-11H2
InChIKeyOHUDYXSPUDOVIR-UHFFFAOYSA-N
XLogP2.75
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-[3-(trifluoromethyl)piperidin-1-yl]butan-1-amine
CID 81080501
1-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]cyclobutan-1-amine
CID 79843616
N-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]butan-2-amine
CID 62573860
N',N'-dimethyl-N-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]ethane-1,2-diamine
CID 62574239
(2S)-1-[3-(trifluoromethyl)piperidin-1-yl]propan-2-ol
CID 103935231
N'-hydroxy-2,2-dimethyl-5-[3-(trifluoromethyl)piperidin-1-yl]pentanimidamide
CID 77073400
2-[(3R)-3-(trifluoromethyl)pyrrolidin-1-yl]ethanamine
CID 96745643
4-[3-(trifluoromethyl)piperidin-1-yl]but-2-en-1-amine
CID 77110534
(3S)-3-(trifluoromethyl)-1-[[2-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]methyl]piperidine
CID 97313441
1-[3-(4-bromophenyl)propyl]-3-(trifluoromethyl)piperidine
CID 175666595
hydrazinyl 3-[3-(trifluoromethyl)piperidin-1-yl]propanoate
CID 66337320
N-ethyl-2-[2-[3-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-amine
CID 79565865

Frequently Asked Questions

What is the IUPAC name of 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine?
The IUPAC name of 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine (CID 126855058) is 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine.
What is the SMILES notation for 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine?
The canonical SMILES for 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine is FC(F)(F)C1CCCN(CCN2CCCCC2)C1.
What is the InChIKey of 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine?
The InChIKey is OHUDYXSPUDOVIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23F3N2/c14-13(15,16)12-5-4-8-18(11-12)10-9-17-6-2-1-3-7-17/h12H,1-11H2.
What are the key properties of 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine?
1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine has a molecular weight of 264.33 g/mol, XLogP of 2.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-piperidin-1-ylethyl)-3-(trifluoromethyl)piperidine is sourced from PubChem (CID 126855058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).