2-amino-6-(trifluoromethoxy)benzamide

C8H7F3N2O2 — CID 119018163

IUPAC2-amino-6-(trifluoromethoxy)benzamide
SMILESNC(=O)c1c(N)cccc1OC(F)(F)F
InChIInChI=1S/C8H7F3N2O2/c9-8(10,11)15-5-3-1-2-4(12)6(5)7(13)14/h1-3H,12H2,(H2,13,14)
InChIKeyHNFKTROUULYFRJ-UHFFFAOYSA-N
MW220.15 g/mol
LogP1.27
Rot. Bonds2

About 2-amino-6-(trifluoromethoxy)benzamide

2-amino-6-(trifluoromethoxy)benzamide (PubChem CID 119018163) has the molecular formula C8H7F3N2O2 and a molecular weight of 220.15 g/mol. Its IUPAC name is 2-amino-6-(trifluoromethoxy)benzamide.

Molecular Properties

Compound Name2-amino-6-(trifluoromethoxy)benzamide
PubChem CID119018163
Molecular FormulaC8H7F3N2O2
Molecular Weight220.15 g/mol
Exact Mass220.05
IUPAC Name2-amino-6-(trifluoromethoxy)benzamide
SMILESNC(=O)c1c(N)cccc1OC(F)(F)F
InChIInChI=1S/C8H7F3N2O2/c9-8(10,11)15-5-3-1-2-4(12)6(5)7(13)14/h1-3H,12H2,(H2,13,14)
InChIKeyHNFKTROUULYFRJ-UHFFFAOYSA-N
XLogP1.27
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.15
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-6-(trifluoromethoxy)benzoic acid
CID 11096155
2-amino-4-bromo-6-(trifluoromethoxy)benzamide
CID 119024469
2-fluoro-3-(trifluoromethoxy)aniline
CID 25210503
2-(trifluoromethoxy)aniline;dihydrochloride
CID 69022411
6-amino-3-chloro-2-(trifluoromethoxy)benzamide
CID 131280730
ethyl 2-methoxy-6-(trifluoromethoxy)benzoate
CID 170997101
2-amino-6-[2-(trifluoromethoxy)ethoxy]benzoic acid
CID 107341705
2-formyl-6-(trifluoromethoxy)benzoic acid
CID 86042749
3-amino-3-[2-hydroxy-3-(trifluoromethoxy)phenyl]propanamide
CID 170876399
2-formyl-6-(trifluoromethoxy)benzoyl chloride
CID 170998157
2-bromo-1-[2-fluoro-6-(trifluoromethoxy)phenyl]ethanone
CID 171028640
2-amino-6-fluoro-4-(trifluoromethoxy)benzamide
CID 119008473

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(trifluoromethoxy)benzamide?
The IUPAC name of 2-amino-6-(trifluoromethoxy)benzamide (CID 119018163) is 2-amino-6-(trifluoromethoxy)benzamide.
What is the SMILES notation for 2-amino-6-(trifluoromethoxy)benzamide?
The canonical SMILES for 2-amino-6-(trifluoromethoxy)benzamide is NC(=O)c1c(N)cccc1OC(F)(F)F.
What is the InChIKey of 2-amino-6-(trifluoromethoxy)benzamide?
The InChIKey is HNFKTROUULYFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O2/c9-8(10,11)15-5-3-1-2-4(12)6(5)7(13)14/h1-3H,12H2,(H2,13,14).
What are the key properties of 2-amino-6-(trifluoromethoxy)benzamide?
2-amino-6-(trifluoromethoxy)benzamide has a molecular weight of 220.15 g/mol, XLogP of 1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(trifluoromethoxy)benzamide is sourced from PubChem (CID 119018163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).