6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide

C9H15F3N2O — CID 24704463

IUPAC6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
SMILESCC1CCCC(C(=O)NCC(F)(F)F)N1
InChIInChI=1S/C9H15F3N2O/c1-6-3-2-4-7(14-6)8(15)13-5-9(10,11)12/h6-7,14H,2-5H2,1H3,(H,13,15)
InChIKeyHKNZCBPDBBAUIN-UHFFFAOYSA-N
MW224.23 g/mol
LogP1.20
Rot. Bonds2

About 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide

6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide (PubChem CID 24704463) has the molecular formula C9H15F3N2O and a molecular weight of 224.23 g/mol. Its IUPAC name is 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
PubChem CID24704463
Molecular FormulaC9H15F3N2O
Molecular Weight224.23 g/mol
Exact Mass224.11
IUPAC Name6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
SMILESCC1CCCC(C(=O)NCC(F)(F)F)N1
InChIInChI=1S/C9H15F3N2O/c1-6-3-2-4-7(14-6)8(15)13-5-9(10,11)12/h6-7,14H,2-5H2,1H3,(H,13,15)
InChIKeyHKNZCBPDBBAUIN-UHFFFAOYSA-N
XLogP1.20
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclopentylethyl)-6-methylpiperidine-2-carboxamide
CID 54932990
6-methyl-N-(2-methylpropyl)piperidine-2-carboxamide
CID 24690890
6-methyl-N-[2-(methylsulfamoyl)ethyl]piperidine-2-carboxamide
CID 114175577
6-methyl-N-(2-methylbutyl)piperidine-2-carboxamide
CID 62694589
N-[(1-ethylcyclopentyl)methyl]-6-methylpiperidine-2-carboxamide
CID 114125672
(2S)-N-(2,2,2-trifluoroethyl)aziridine-2-carboxamide
CID 97184752
cis-(1S,2R)-1-N,2-N-bis(2,2,2-trifluoroethyl)cyclopentane-1,2-dicarboxamide
CID 97068565
6-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 62641371
6-methyl-N-(oxan-2-ylmethyl)piperidine-2-carboxamide
CID 55013596
N-cyclooctyl-6-methylpiperidine-2-carboxamide
CID 43185115
2-(2,2,2-trifluoroethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103977876
6-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]piperidine-2-carboxamide
CID 114140614

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The IUPAC name of 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide (CID 24704463) is 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The canonical SMILES for 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide is CC1CCCC(C(=O)NCC(F)(F)F)N1.
What is the InChIKey of 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The InChIKey is HKNZCBPDBBAUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2O/c1-6-3-2-4-7(14-6)8(15)13-5-9(10,11)12/h6-7,14H,2-5H2,1H3,(H,13,15).
What are the key properties of 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide has a molecular weight of 224.23 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide is sourced from PubChem (CID 24704463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).