N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide

C16H15F3N2O2 — CID 15027386

IUPACN-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide
SMILESCC(=O)N(O)Cc1ccccc1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C16H15F3N2O2/c1-11(22)21(23)10-12-5-2-3-8-15(12)20-14-7-4-6-13(9-14)16(17,18)19/h2-9,20,23H,10H2,1H3
InChIKeyHMEKYKHQLRACOM-UHFFFAOYSA-N
MW324.30 g/mol
LogP4.19
Rot. Bonds4

About N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide

N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide (PubChem CID 15027386) has the molecular formula C16H15F3N2O2 and a molecular weight of 324.30 g/mol. Its IUPAC name is N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide
PubChem CID15027386
Molecular FormulaC16H15F3N2O2
Molecular Weight324.30 g/mol
Exact Mass324.11
IUPAC NameN-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide
SMILESCC(=O)N(O)Cc1ccccc1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C16H15F3N2O2/c1-11(22)21(23)10-12-5-2-3-8-15(12)20-14-7-4-6-13(9-14)16(17,18)19/h2-9,20,23H,10H2,1H3
InChIKeyHMEKYKHQLRACOM-UHFFFAOYSA-N
XLogP4.19
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.30
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-N-[3-(trifluoromethyl)phenyl]aniline
CID 142875759
ethane;2-[3-(trifluoromethyl)anilino]benzamide
CID 142468111
4-N-(2-ethylphenyl)-6-N-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine
CID 22544122
2-[2-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]acetic acid
CID 10268726
2-N-[3-(trifluoromethyl)phenyl]benzene-1,2-diamine
CID 3729763
[2-(2-acetylhydrazinyl)-2-oxoethyl] 2-[3-(trifluoromethyl)anilino]benzoate
CID 8789976
(2-methoxy-2-oxoethyl) 2-[3-(trifluoromethyl)anilino]benzoate
CID 16619639
2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 9303896
2-[2-[2-[3-(trifluoromethyl)anilino]benzoyl]oxyethoxy]ethyl 2-[3-(trifluoromethyl)anilino]benzoate
CID 129318388
3-(2-ethylanilino)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 109036212
2-fluoro-N-phenyl-3-[3-(trifluoromethyl)anilino]benzamide
CID 10547402
1-(2-sulfanylphenyl)-3-[3-(trifluoromethyl)phenyl]urea
CID 108886280

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide?
The IUPAC name of N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide (CID 15027386) is N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide.
What is the SMILES notation for N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide?
The canonical SMILES for N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide is CC(=O)N(O)Cc1ccccc1Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide?
The InChIKey is HMEKYKHQLRACOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O2/c1-11(22)21(23)10-12-5-2-3-8-15(12)20-14-7-4-6-13(9-14)16(17,18)19/h2-9,20,23H,10H2,1H3.
What are the key properties of N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide?
N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide has a molecular weight of 324.30 g/mol, XLogP of 4.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-[[2-[3-(trifluoromethyl)anilino]phenyl]methyl]acetamide is sourced from PubChem (CID 15027386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).