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

C12H21F3N2O — CID 55009103

IUPAC6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
SMILESCC1CCCC(C(=O)N(CC(F)(F)F)C(C)C)N1
InChIInChI=1S/C12H21F3N2O/c1-8(2)17(7-12(13,14)15)11(18)10-6-4-5-9(3)16-10/h8-10,16H,4-7H2,1-3H3
InChIKeyGSONDSQFSVBCTN-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.32
Rot. Bonds3

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

6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide (PubChem CID 55009103) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
PubChem CID55009103
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC Name6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
SMILESCC1CCCC(C(=O)N(CC(F)(F)F)C(C)C)N1
InChIInChI=1S/C12H21F3N2O/c1-8(2)17(7-12(13,14)15)11(18)10-6-4-5-9(3)16-10/h8-10,16H,4-7H2,1-3H3
InChIKeyGSONDSQFSVBCTN-UHFFFAOYSA-N
XLogP2.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-N-(2-methylpropyl)-N-propan-2-ylpiperidine-2-carboxamide
CID 55000149
2-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 79388128
6-methyl-N,N-bis(3-methylbutyl)piperidine-2-carboxamide
CID 107869879
6-methyl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 24704463
N,6-dimethyl-N-pentan-2-ylpiperidine-2-carboxamide
CID 43572461
N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide
CID 54870149
5-amino-2,4-dimethyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide
CID 102706640
6-methyl-N-[2-(methylsulfamoyl)ethyl]piperidine-2-carboxamide
CID 114175577
6-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 62641371
2-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 60770828
2,2,2-trifluoro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 64592645
2-(azetidin-3-yl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 64610975

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The IUPAC name of 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide (CID 55009103) is 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The canonical SMILES for 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide is CC1CCCC(C(=O)N(CC(F)(F)F)C(C)C)N1.
What is the InChIKey of 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
The InChIKey is GSONDSQFSVBCTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c1-8(2)17(7-12(13,14)15)11(18)10-6-4-5-9(3)16-10/h8-10,16H,4-7H2,1-3H3.
What are the key properties of 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide?
6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide has a molecular weight of 266.31 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-2-carboxamide is sourced from PubChem (CID 55009103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).