N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide

C10H15F3N2O2 — CID 52904894

IUPACN,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)C(F)(F)F)CC1
InChIInChI=1S/C10H15F3N2O2/c1-14(2)8(16)7-3-5-15(6-4-7)9(17)10(11,12)13/h7H,3-6H2,1-2H3
InChIKeyFROPIOSKWSVRNB-UHFFFAOYSA-N
MW252.24 g/mol
LogP0.88
Rot. Bonds1

About N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide

N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide (PubChem CID 52904894) has the molecular formula C10H15F3N2O2 and a molecular weight of 252.24 g/mol. Its IUPAC name is N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
PubChem CID52904894
Molecular FormulaC10H15F3N2O2
Molecular Weight252.24 g/mol
Exact Mass252.11
IUPAC NameN,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)C(F)(F)F)CC1
InChIInChI=1S/C10H15F3N2O2/c1-14(2)8(16)7-3-5-15(6-4-7)9(17)10(11,12)13/h7H,3-6H2,1-2H3
InChIKeyFROPIOSKWSVRNB-UHFFFAOYSA-N
XLogP0.88
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.24
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Diacetylpiperidine
CID 2777250
1-Acetylpiperidine-4-carboxamide
CID 18474173
1-(Trifluoroacetyl)piperidine-4-carbaldehyde
CID 45081042
Isonipecotamide, 1-acetyl-N,N-diethyl-
CID 238087
2-Fluoro-1-(4-methylpiperidin-1-yl)ethanone
CID 45080727
1-acetyl-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 146018721
2,2,2-Trifluoro-1-(4-fluoro-4-methylpiperidin-1-yl)ethanone
CID 101850279
1-(cis-3,5-Difluoro-4-methylpiperidin-1-yl)-2,2,2-trifluoroethan-1-one
CID 134827912
2,2,2-Trifluoro-1-(cis-3-fluoro-4-methylpiperidin-1-yl)ethan-1-one
CID 134827931
N,N,1-Trimethylpiperidine-4-carboxamide
CID 17980358
N,N,1-Triethyl-4-piperidinecarboxamide monohydriodide
CID 24185716
N,N-Diethyl-1-methyl-4-piperidinecarboxamide monohydriodide
CID 24185717

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide?
The IUPAC name of N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide (CID 52904894) is N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide is CN(C)C(=O)C1CCN(C(=O)C(F)(F)F)CC1.
What is the InChIKey of N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide?
The InChIKey is FROPIOSKWSVRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2O2/c1-14(2)8(16)7-3-5-15(6-4-7)9(17)10(11,12)13/h7H,3-6H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide?
N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide has a molecular weight of 252.24 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide is sourced from PubChem (CID 52904894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).