N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide

C11H17F3N2O2 — CID 87524350

IUPACN-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide
SMILESCNC(=O)C(NC(=O)C(F)(F)F)C1CCCCC1
InChIInChI=1S/C11H17F3N2O2/c1-15-9(17)8(7-5-3-2-4-6-7)16-10(18)11(12,13)14/h7-8H,2-6H2,1H3,(H,15,17)(H,16,18)
InChIKeyZPUZXAARIFEHLP-UHFFFAOYSA-N
MW266.26 g/mol
LogP1.36
Rot. Bonds3

About N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide

N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide (PubChem CID 87524350) has the molecular formula C11H17F3N2O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide
PubChem CID87524350
Molecular FormulaC11H17F3N2O2
Molecular Weight266.26 g/mol
Exact Mass266.12
IUPAC NameN-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide
SMILESCNC(=O)C(NC(=O)C(F)(F)F)C1CCCCC1
InChIInChI=1S/C11H17F3N2O2/c1-15-9(17)8(7-5-3-2-4-6-7)16-10(18)11(12,13)14/h7-8H,2-6H2,1H3,(H,15,17)(H,16,18)
InChIKeyZPUZXAARIFEHLP-UHFFFAOYSA-N
XLogP1.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide?
The IUPAC name of N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide (CID 87524350) is N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide?
The canonical SMILES for N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide is CNC(=O)C(NC(=O)C(F)(F)F)C1CCCCC1.
What is the InChIKey of N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide?
The InChIKey is ZPUZXAARIFEHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N2O2/c1-15-9(17)8(7-5-3-2-4-6-7)16-10(18)11(12,13)14/h7-8H,2-6H2,1H3,(H,15,17)(H,16,18).
What are the key properties of N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide?
N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide has a molecular weight of 266.26 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclohexyl-2-(methylamino)-2-oxoethyl]-2,2,2-trifluoroacetamide is sourced from PubChem (CID 87524350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).