2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide

C10H12F3N3O — CID 119861596

IUPAC2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide
SMILESNCC(=O)Nc1ccccc1NCC(F)(F)F
InChIInChI=1S/C10H12F3N3O/c11-10(12,13)6-15-7-3-1-2-4-8(7)16-9(17)5-14/h1-4,15H,5-6,14H2,(H,16,17)
InChIKeyFKXMCURTTDWKLA-UHFFFAOYSA-N
MW247.22 g/mol
LogP1.56
Rot. Bonds4

About 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide

2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide (PubChem CID 119861596) has the molecular formula C10H12F3N3O and a molecular weight of 247.22 g/mol. Its IUPAC name is 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide
PubChem CID119861596
Molecular FormulaC10H12F3N3O
Molecular Weight247.22 g/mol
Exact Mass247.09
IUPAC Name2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide
SMILESNCC(=O)Nc1ccccc1NCC(F)(F)F
InChIInChI=1S/C10H12F3N3O/c11-10(12,13)6-15-7-3-1-2-4-8(7)16-9(17)5-14/h1-4,15H,5-6,14H2,(H,16,17)
InChIKeyFKXMCURTTDWKLA-UHFFFAOYSA-N
XLogP1.56
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-2-methyl-N-[2-(2,2,2-trifluoroethylamino)phenyl]butanamide;dihydrochloride
CID 120503282
3-(4-methoxyphenyl)-N-[2-(2,2,2-trifluoroethylamino)phenyl]propanamide
CID 47829673
N-(2-bromophenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 28595976
2-methylsulfanyl-N-[2-(2,2,2-trifluoroethylamino)phenyl]benzamide
CID 99841149
N-(2-tert-butylphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914752
2-amino-N-(2-chlorophenyl)acetamide;hydrochloride
CID 51051964
2-amino-N-(2-cyano-3-fluorophenyl)acetamide
CID 43580746
2,5-dimethyl-N-[2-(2,2,2-trifluoroethylamino)phenyl]furan-3-carboxamide
CID 47076260
5-methyl-N-[2-(2,2,2-trifluoroethylamino)phenyl]pyrazine-2-carboxamide
CID 47829593
4-(difluoromethylsulfanyl)-N-[2-(2,2,2-trifluoroethylamino)phenyl]benzamide
CID 47829508
2-amino-N-naphthalen-1-ylacetamide;hydrochloride
CID 47003070
2-fluoro-N-(2,2,2-trifluoroethyl)aniline
CID 28581729

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide?
The IUPAC name of 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide (CID 119861596) is 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide is NCC(=O)Nc1ccccc1NCC(F)(F)F.
What is the InChIKey of 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide?
The InChIKey is FKXMCURTTDWKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O/c11-10(12,13)6-15-7-3-1-2-4-8(7)16-9(17)5-14/h1-4,15H,5-6,14H2,(H,16,17).
What are the key properties of 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide?
2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide has a molecular weight of 247.22 g/mol, XLogP of 1.56, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2,2,2-trifluoroethylamino)phenyl]acetamide is sourced from PubChem (CID 119861596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).