N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide

C16H25F3N2O3 — CID 128989593

IUPACN-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCC(C(F)(F)F)N(C(=O)COC2CCCCC2)C1
InChIInChI=1S/C16H25F3N2O3/c1-11(22)20-12-7-8-14(16(17,18)19)21(9-12)15(23)10-24-13-5-3-2-4-6-13/h12-14H,2-10H2,1H3,(H,20,22)
InChIKeyFTRDDSLYCNSXIQ-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.39
Rot. Bonds4

About N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide

N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide (PubChem CID 128989593) has the molecular formula C16H25F3N2O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide
PubChem CID128989593
Molecular FormulaC16H25F3N2O3
Molecular Weight350.38 g/mol
Exact Mass350.18
IUPAC NameN-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCC(C(F)(F)F)N(C(=O)COC2CCCCC2)C1
InChIInChI=1S/C16H25F3N2O3/c1-11(22)20-12-7-8-14(16(17,18)19)21(9-12)15(23)10-24-13-5-3-2-4-6-13/h12-14H,2-10H2,1H3,(H,20,22)
InChIKeyFTRDDSLYCNSXIQ-UHFFFAOYSA-N
XLogP2.39
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide?
The IUPAC name of N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide (CID 128989593) is N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide?
The canonical SMILES for N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide is CC(=O)NC1CCC(C(F)(F)F)N(C(=O)COC2CCCCC2)C1.
What is the InChIKey of N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide?
The InChIKey is FTRDDSLYCNSXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25F3N2O3/c1-11(22)20-12-7-8-14(16(17,18)19)21(9-12)15(23)10-24-13-5-3-2-4-6-13/h12-14H,2-10H2,1H3,(H,20,22).
What are the key properties of N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide?
N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide has a molecular weight of 350.38 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-cyclohexyloxyacetyl)-6-(trifluoromethyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 128989593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).