2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide

C14H16F3NO2 — CID 71998916

IUPAC2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide
SMILESCOCC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1
InChIInChI=1S/C14H16F3NO2/c1-20-9-12(19)18-13(6-3-7-13)10-4-2-5-11(8-10)14(15,16)17/h2,4-5,8H,3,6-7,9H2,1H3,(H,18,19)
InChIKeyLKDVYBCUVRRLDU-UHFFFAOYSA-N
MW287.28 g/mol
LogP2.85
Rot. Bonds4

About 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide

2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide (PubChem CID 71998916) has the molecular formula C14H16F3NO2 and a molecular weight of 287.28 g/mol. Its IUPAC name is 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide
PubChem CID71998916
Molecular FormulaC14H16F3NO2
Molecular Weight287.28 g/mol
Exact Mass287.11
IUPAC Name2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide
SMILESCOCC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1
InChIInChI=1S/C14H16F3NO2/c1-20-9-12(19)18-13(6-3-7-13)10-4-2-5-11(8-10)14(15,16)17/h2,4-5,8H,3,6-7,9H2,1H3,(H,18,19)
InChIKeyLKDVYBCUVRRLDU-UHFFFAOYSA-N
XLogP2.85
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.28
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 134793956
2-methoxy-N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide
CID 16071105
2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide
CID 134893612
2-methoxy-N-[3,3,3-trifluoro-1-(4-methylphenyl)propyl]acetamide
CID 138980687
N-[1-(fluoromethoxy)-2-phenylpropan-2-yl]acetamide
CID 177853411
4,4,4-trifluoro-N-[(2R)-1-methoxy-2-phenylpropan-2-yl]butanamide
CID 96560008
N-[(1S)-2-cyclobutyl-1-phenylethyl]-2-methoxyacetamide
CID 97802480
N-(1,1,1-trifluoro-2-phenylpropan-2-yl)acetamide
CID 15350114
2,2,2-Trifluoro-N-(2-phenylpropan-2-yl)acetamide
CID 91703146
2-(2-methoxyethoxy)-N-[2-phenyl-1,1-bis[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 58898130
2-methoxy-N-[2-phenyl-1,1-bis[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 59458569
[2-Oxo-2-[[2-phenyl-1,1-bis[3-(trifluoromethyl)phenyl]ethyl]amino]ethyl] acetate
CID 59458885

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide?
The IUPAC name of 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide (CID 71998916) is 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide?
The canonical SMILES for 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide is COCC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1.
What is the InChIKey of 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide?
The InChIKey is LKDVYBCUVRRLDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3NO2/c1-20-9-12(19)18-13(6-3-7-13)10-4-2-5-11(8-10)14(15,16)17/h2,4-5,8H,3,6-7,9H2,1H3,(H,18,19).
What are the key properties of 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide?
2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide has a molecular weight of 287.28 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide is sourced from PubChem (CID 71998916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).