N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide

C11H18F3N3O2 — CID 103102667

IUPACN-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCCN(CC(N)=O)C(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C11H18F3N3O2/c1-2-17(6-9(15)18)10(19)8-4-3-7(5-16-8)11(12,13)14/h7-8,16H,2-6H2,1H3,(H2,15,18)
InChIKeyUDLOQUHJFKRUDJ-UHFFFAOYSA-N
MW281.28 g/mol
LogP0.25
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide

N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide (PubChem CID 103102667) has the molecular formula C11H18F3N3O2 and a molecular weight of 281.28 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide
PubChem CID103102667
Molecular FormulaC11H18F3N3O2
Molecular Weight281.28 g/mol
Exact Mass281.14
IUPAC NameN-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCCN(CC(N)=O)C(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C11H18F3N3O2/c1-2-17(6-9(15)18)10(19)8-4-3-7(5-16-8)11(12,13)14/h7-8,16H,2-6H2,1H3,(H2,15,18)
InChIKeyUDLOQUHJFKRUDJ-UHFFFAOYSA-N
XLogP0.25
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide (CID 103102667) is N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide is CCN(CC(N)=O)C(=O)C1CCC(C(F)(F)F)CN1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide?
The InChIKey is UDLOQUHJFKRUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3N3O2/c1-2-17(6-9(15)18)10(19)8-4-3-7(5-16-8)11(12,13)14/h7-8,16H,2-6H2,1H3,(H2,15,18).
What are the key properties of N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide?
N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide has a molecular weight of 281.28 g/mol, XLogP of 0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide is sourced from PubChem (CID 103102667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).