2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide

C10H10F4N2O2 — CID 100756707

IUPAC2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide
SMILESNC(=O)CNCc1c(F)cccc1OC(F)(F)F
InChIInChI=1S/C10H10F4N2O2/c11-7-2-1-3-8(18-10(12,13)14)6(7)4-16-5-9(15)17/h1-3,16H,4-5H2,(H2,15,17)
InChIKeyPOWJNDSBFOKTQG-UHFFFAOYSA-N
MW266.19 g/mol
LogP1.30
Rot. Bonds5

About 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide

2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide (PubChem CID 100756707) has the molecular formula C10H10F4N2O2 and a molecular weight of 266.19 g/mol. Its IUPAC name is 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide.

Molecular Properties

Compound Name2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide
PubChem CID100756707
Molecular FormulaC10H10F4N2O2
Molecular Weight266.19 g/mol
Exact Mass266.07
IUPAC Name2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide
SMILESNC(=O)CNCc1c(F)cccc1OC(F)(F)F
InChIInChI=1S/C10H10F4N2O2/c11-7-2-1-3-8(18-10(12,13)14)6(7)4-16-5-9(15)17/h1-3,16H,4-5H2,(H2,15,17)
InChIKeyPOWJNDSBFOKTQG-UHFFFAOYSA-N
XLogP1.30
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.19
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]methyl]-4-methylpentanoic acid
CID 122073360
2-ethyl-1-fluoro-3-(trifluoromethoxy)benzene
CID 131169258
ethyl (2R)-2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]-2-(3-hydroxyphenyl)acetate
CID 100756781
2-(2-chloro-6-fluorophenyl)-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide
CID 26012483
2-bromo-1-[2-fluoro-6-(trifluoromethoxy)phenyl]ethanone
CID 171028640
[2-fluoro-6-[2-(trifluoromethoxy)phenyl]phenyl]methanamine
CID 134631493
2-fluoro-6-(trifluoromethoxy)phenol
CID 68960936
1-bromo-1-[2-fluoro-6-(trifluoromethoxy)phenyl]propan-2-one
CID 134615787
1-[2-(chloromethyl)-6-(trifluoromethoxy)phenyl]propan-2-one
CID 166640657
1-[(2-fluorophenyl)methyl]-3-[2-(trifluoromethoxy)phenyl]urea
CID 52595761
ethyl 2-[2-formyl-6-(trifluoromethoxy)phenyl]acetate
CID 170998210
2-hydroxy-3-[[2-(trifluoromethoxy)phenyl]methylamino]propanamide
CID 106170862

Frequently Asked Questions

What is the IUPAC name of 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide?
The IUPAC name of 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide (CID 100756707) is 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide.
What is the SMILES notation for 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide?
The canonical SMILES for 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide is NC(=O)CNCc1c(F)cccc1OC(F)(F)F.
What is the InChIKey of 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide?
The InChIKey is POWJNDSBFOKTQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F4N2O2/c11-7-2-1-3-8(18-10(12,13)14)6(7)4-16-5-9(15)17/h1-3,16H,4-5H2,(H2,15,17).
What are the key properties of 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide?
2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide has a molecular weight of 266.19 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-fluoro-6-(trifluoromethoxy)phenyl]methylamino]acetamide is sourced from PubChem (CID 100756707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).