2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide

C10H11F3N2O — CID 119333864

IUPAC2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide
SMILESNCC(=O)Nc1cccc(CC(F)(F)F)c1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)5-7-2-1-3-8(4-7)15-9(16)6-14/h1-4H,5-6,14H2,(H,15,16)
InChIKeyDJWCJISRIYTQCM-UHFFFAOYSA-N
MW232.20 g/mol
LogP1.69
Rot. Bonds3

About 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide

2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide (PubChem CID 119333864) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide
PubChem CID119333864
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC Name2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide
SMILESNCC(=O)Nc1cccc(CC(F)(F)F)c1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)5-7-2-1-3-8(4-7)15-9(16)6-14/h1-4H,5-6,14H2,(H,15,16)
InChIKeyDJWCJISRIYTQCM-UHFFFAOYSA-N
XLogP1.69
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylamino)-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide;hydrochloride
CID 119801597
1,1-dimethyl-3-[3-(2,2,2-trifluoroethyl)phenyl]urea
CID 70150186
(2S)-2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]propanamide;hydrochloride
CID 119333857
N-[[3-[(2-aminoacetyl)amino]phenyl]methyl]-2,2,2-trifluoro-N-methylacetamide
CID 119294226
2-amino-N-[3-(2,2-dihydroxyethyl)phenyl]acetamide
CID 175163451
3-amino-2-methyl-N-[3-(2,2,2-trifluoroethyl)phenyl]butanamide
CID 120501532
3-amino-N-[3-(3,3,3-trifluoropropyl)phenyl]propanamide
CID 119343965
2-methoxy-2-methyl-3-oxo-3-[3-(2,2,2-trifluoroethyl)anilino]propanoic acid
CID 146136066
2-amino-N-[3-[(dimethylamino)methyl]phenyl]acetamide;dihydrochloride
CID 119853176
N-[3-(2,2,2-trifluoroethyl)phenyl]piperidine-4-carboxamide
CID 119333866
methyl (2R)-2-methyl-3-[[3-(2,2,2-trifluoroethyl)phenyl]carbamoylamino]propanoate
CID 97048361
2-amino-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 43697313

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide?
The IUPAC name of 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide (CID 119333864) is 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide?
The canonical SMILES for 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide is NCC(=O)Nc1cccc(CC(F)(F)F)c1.
What is the InChIKey of 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide?
The InChIKey is DJWCJISRIYTQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c11-10(12,13)5-7-2-1-3-8(4-7)15-9(16)6-14/h1-4H,5-6,14H2,(H,15,16).
What are the key properties of 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide?
2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide has a molecular weight of 232.20 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(2,2,2-trifluoroethyl)phenyl]acetamide is sourced from PubChem (CID 119333864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).