1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine

C14H24F3N — CID 134996573

IUPAC1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine
SMILESCCCCCC/C=C(/N1CCCCC1)C(F)(F)F
InChIInChI=1S/C14H24F3N/c1-2-3-4-5-7-10-13(14(15,16)17)18-11-8-6-9-12-18/h10H,2-9,11-12H2,1H3/b13-10+
InChIKeyKVLORXVCLQHKBD-JLHYYAGUSA-N
MW263.35 g/mol
LogP4.89
Rot. Bonds6

About 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine

1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine (PubChem CID 134996573) has the molecular formula C14H24F3N and a molecular weight of 263.35 g/mol. Its IUPAC name is 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine.

Molecular Properties

Compound Name1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine
PubChem CID134996573
Molecular FormulaC14H24F3N
Molecular Weight263.35 g/mol
Exact Mass263.19
IUPAC Name1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine
SMILESCCCCCC/C=C(/N1CCCCC1)C(F)(F)F
InChIInChI=1S/C14H24F3N/c1-2-3-4-5-7-10-13(14(15,16)17)18-11-8-6-9-12-18/h10H,2-9,11-12H2,1H3/b13-10+
InChIKeyKVLORXVCLQHKBD-JLHYYAGUSA-N
XLogP4.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.35
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(Cyclohepten-1-yl)piperidine
CID 12492386
1-[(Z)-1,1,1-trifluoronon-2-en-2-yl]piperidine
CID 101627248
N-(1,1,2,2,3,3,3-heptafluoropropyl)-N-(2,2,2-trifluoroethyl)cyclohexen-1-amine
CID 162455182
N-methyl-N-(trifluoromethyl)cyclohexen-1-amine
CID 166661074
1-[(2E,6E)-7-fluorohepta-2,6-dien-2-yl]piperidine
CID 169983551
2-Methylidene-1-propan-2-yl-6-(trifluoromethyl)piperidine
CID 171846003
1-[(E)-undec-2-en-3-yl]piperidine
CID 14248042
1-[(Z)-undec-2-en-3-yl]piperidine
CID 134933438
1-Methyl-7-(trifluoromethyl)-2,3,4,5-tetrahydroazepine
CID 10965106
1-[(Z)-1-cyclohexyl-3,3,3-trifluoroprop-1-en-2-yl]piperidine
CID 101627258
1-[(E)-1,1,1-trifluorooct-2-en-2-yl]piperidine
CID 177623090
Methyl pinidine
CID 5372416

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine?
The IUPAC name of 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine (CID 134996573) is 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine.
What is the SMILES notation for 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine?
The canonical SMILES for 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine is CCCCCC/C=C(/N1CCCCC1)C(F)(F)F.
What is the InChIKey of 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine?
The InChIKey is KVLORXVCLQHKBD-JLHYYAGUSA-N. The full InChI is InChI=1S/C14H24F3N/c1-2-3-4-5-7-10-13(14(15,16)17)18-11-8-6-9-12-18/h10H,2-9,11-12H2,1H3/b13-10+.
What are the key properties of 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine?
1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine has a molecular weight of 263.35 g/mol, XLogP of 4.89, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-1,1,1-trifluoronon-2-en-2-yl]piperidine is sourced from PubChem (CID 134996573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).