N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide

C13H20F3NO2 — CID 170085632

IUPACN-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide
SMILESO=C(COC1CC(C(F)(F)F)C1)NC1CCCCC1
InChIInChI=1S/C13H20F3NO2/c14-13(15,16)9-6-11(7-9)19-8-12(18)17-10-4-2-1-3-5-10/h9-11H,1-8H2,(H,17,18)
InChIKeyRDMJHDGNSJITQM-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.79
Rot. Bonds4

About N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide

N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide (PubChem CID 170085632) has the molecular formula C13H20F3NO2 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide
PubChem CID170085632
Molecular FormulaC13H20F3NO2
Molecular Weight279.30 g/mol
Exact Mass279.14
IUPAC NameN-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide
SMILESO=C(COC1CC(C(F)(F)F)C1)NC1CCCCC1
InChIInChI=1S/C13H20F3NO2/c14-13(15,16)9-6-11(7-9)19-8-12(18)17-10-4-2-1-3-5-10/h9-11H,1-8H2,(H,17,18)
InChIKeyRDMJHDGNSJITQM-UHFFFAOYSA-N
XLogP2.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide?
The IUPAC name of N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide (CID 170085632) is N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide.
What is the SMILES notation for N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide?
The canonical SMILES for N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide is O=C(COC1CC(C(F)(F)F)C1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide?
The InChIKey is RDMJHDGNSJITQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F3NO2/c14-13(15,16)9-6-11(7-9)19-8-12(18)17-10-4-2-1-3-5-10/h9-11H,1-8H2,(H,17,18).
What are the key properties of N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide?
N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide has a molecular weight of 279.30 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[3-(trifluoromethyl)cyclobutyl]oxyacetamide is sourced from PubChem (CID 170085632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).