N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide

C16H15F3N2O — CID 7409922

IUPACN-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
SMILESCc1cccc(NC(=O)CNc2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C16H15F3N2O/c1-11-4-2-7-14(8-11)21-15(22)10-20-13-6-3-5-12(9-13)16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22)
InChIKeyUYUUVGPOHBTPJS-UHFFFAOYSA-N
MW308.30 g/mol
LogP4.06
Rot. Bonds4

About N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide

N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide (PubChem CID 7409922) has the molecular formula C16H15F3N2O and a molecular weight of 308.30 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
PubChem CID7409922
Molecular FormulaC16H15F3N2O
Molecular Weight308.30 g/mol
Exact Mass308.11
IUPAC NameN-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
SMILESCc1cccc(NC(=O)CNc2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C16H15F3N2O/c1-11-4-2-7-14(8-11)21-15(22)10-20-13-6-3-5-12(9-13)16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22)
InChIKeyUYUUVGPOHBTPJS-UHFFFAOYSA-N
XLogP4.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.30
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 54833567
N-(3,4-difluorophenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 7409925
N-(3,4-dichlorophenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 7922707
N-(3-propan-2-yloxyphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 54833563
N-(3-ethoxyphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 54833710
N-tert-butyl-3-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 54833776
N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 109009742
3-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]amino]-N-propan-2-ylbenzamide
CID 54833466
2-(4-propan-2-yloxyanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 54822451
N-[3-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]amino]phenyl]-3-phenylpropanamide
CID 54837317
3-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]amino]-N-propylbenzamide
CID 54838617
2-[(5-methyl-1,2-oxazol-3-yl)amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 109009780

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide (CID 7409922) is N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide is Cc1cccc(NC(=O)CNc2cccc(C(F)(F)F)c2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide?
The InChIKey is UYUUVGPOHBTPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O/c1-11-4-2-7-14(8-11)21-15(22)10-20-13-6-3-5-12(9-13)16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22).
What are the key properties of N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide?
N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide has a molecular weight of 308.30 g/mol, XLogP of 4.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 7409922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).