2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid

C17H14F3NO3 — CID 91659625

IUPAC2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid
SMILESO=C(O)Cc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F
InChIInChI=1S/C17H14F3NO3/c18-17(19,20)13-7-3-1-5-11(13)9-15(22)21-14-8-4-2-6-12(14)10-16(23)24/h1-8H,9-10H2,(H,21,22)(H,23,24)
InChIKeyLYZWKGLAFXJYMD-UHFFFAOYSA-N
MW337.30 g/mol
LogP3.51
Rot. Bonds5

About 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid

2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid (PubChem CID 91659625) has the molecular formula C17H14F3NO3 and a molecular weight of 337.30 g/mol. Its IUPAC name is 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid.

Molecular Properties

Compound Name2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid
PubChem CID91659625
Molecular FormulaC17H14F3NO3
Molecular Weight337.30 g/mol
Exact Mass337.09
IUPAC Name2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid
SMILESO=C(O)Cc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F
InChIInChI=1S/C17H14F3NO3/c18-17(19,20)13-7-3-1-5-11(13)9-15(22)21-14-8-4-2-6-12(14)10-16(23)24/h1-8H,9-10H2,(H,21,22)(H,23,24)
InChIKeyLYZWKGLAFXJYMD-UHFFFAOYSA-N
XLogP3.51
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.30
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methanol;2-[2-(trifluoromethyl)phenyl]acetic acid
CID 70254547
2-(4-phenylphenyl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 26087747
2-(1-hydroxyindol-3-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 141490327
3,3-dimethyl-5-oxo-5-[2-(trifluoromethyl)anilino]pentanoic acid
CID 60699495
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
CID 110696997
2-[2-(trifluoromethyl)anilino]acetic acid
CID 21238931
N-(1-phenylpyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]acetamide
CID 135315885
2-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 668862
N-[(2-methylphenyl)methyl]-N'-[2-(trifluoromethyl)phenyl]propanediamide
CID 108945471
2-[2-(trifluoromethyl)phenyl]acetyl bromide
CID 141376906
N,N'-bis[2-(trifluoromethyl)phenyl]oxamide
CID 3696493
2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 21383101

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid?
The IUPAC name of 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid (CID 91659625) is 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid.
What is the SMILES notation for 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid?
The canonical SMILES for 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid is O=C(O)Cc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F.
What is the InChIKey of 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid?
The InChIKey is LYZWKGLAFXJYMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F3NO3/c18-17(19,20)13-7-3-1-5-11(13)9-15(22)21-14-8-4-2-6-12(14)10-16(23)24/h1-8H,9-10H2,(H,21,22)(H,23,24).
What are the key properties of 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid?
2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid has a molecular weight of 337.30 g/mol, XLogP of 3.51, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetic acid is sourced from PubChem (CID 91659625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).