2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine

C10H18F3NO — CID 66275246

IUPAC2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine
SMILESCC(OCCC1CCCCN1)C(F)(F)F
InChIInChI=1S/C10H18F3NO/c1-8(10(11,12)13)15-7-5-9-4-2-3-6-14-9/h8-9,14H,2-7H2,1H3
InChIKeyQKUVQOAMJMWFDZ-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.49
Rot. Bonds4

About 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine

2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine (PubChem CID 66275246) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine.

Molecular Properties

Compound Name2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine
PubChem CID66275246
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine
SMILESCC(OCCC1CCCCN1)C(F)(F)F
InChIInChI=1S/C10H18F3NO/c1-8(10(11,12)13)15-7-5-9-4-2-3-6-14-9/h8-9,14H,2-7H2,1H3
InChIKeyQKUVQOAMJMWFDZ-UHFFFAOYSA-N
XLogP2.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2-propan-2-yloxyethyl)piperidine
CID 28802472
2-methyl-3-(2-piperidin-2-ylethoxy)propan-1-ol
CID 106937955
2-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 10797616
(2R)-2-[2-(3-methylbutoxy)ethyl]piperidine
CID 86313825
2-[2-(3-methylbutoxy)ethyl]piperidine
CID 43149946
2-[1-(2-pyrrolidin-2-ylethoxy)ethyl]pyrrolidine
CID 118611329
(2S)-2-(3-methylbutyl)piperidine
CID 94379266
trimethyl(2-piperidin-2-ylethoxy)silane
CID 116530714
2-[2-(2-cyclohexylethoxy)ethyl]piperidine
CID 56829863
2-(3,3,3-trifluoro-2-methoxypropyl)piperidine
CID 84734554
(2R)-2-(3-propan-2-yloxypropyl)pyrrolidine
CID 134397939
N-methyl-4-piperidin-2-ylbutan-2-amine
CID 84653921

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine?
The IUPAC name of 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine (CID 66275246) is 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine.
What is the SMILES notation for 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine?
The canonical SMILES for 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine is CC(OCCC1CCCCN1)C(F)(F)F.
What is the InChIKey of 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine?
The InChIKey is QKUVQOAMJMWFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-8(10(11,12)13)15-7-5-9-4-2-3-6-14-9/h8-9,14H,2-7H2,1H3.
What are the key properties of 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine?
2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine has a molecular weight of 225.25 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]piperidine is sourced from PubChem (CID 66275246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).