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

C16H15F3N2O2 — CID 31773766

IUPACN-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
SMILESCc1ccccc1NC(=O)CNc1cccc(OC(F)(F)F)c1
InChIInChI=1S/C16H15F3N2O2/c1-11-5-2-3-8-14(11)21-15(22)10-20-12-6-4-7-13(9-12)23-16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22)
InChIKeyVJRKYPSYVLSNKN-UHFFFAOYSA-N
MW324.30 g/mol
LogP3.94
Rot. Bonds5

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

N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide (PubChem CID 31773766) has the molecular formula C16H15F3N2O2 and a molecular weight of 324.30 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
PubChem CID31773766
Molecular FormulaC16H15F3N2O2
Molecular Weight324.30 g/mol
Exact Mass324.11
IUPAC NameN-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
SMILESCc1ccccc1NC(=O)CNc1cccc(OC(F)(F)F)c1
InChIInChI=1S/C16H15F3N2O2/c1-11-5-2-3-8-14(11)21-15(22)10-20-12-6-4-7-13(9-12)23-16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22)
InChIKeyVJRKYPSYVLSNKN-UHFFFAOYSA-N
XLogP3.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.30
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31773740
N-(2-iodophenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31774679
N-methyl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586079
N-(2-methyl-3-nitrophenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 55544484
N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586058
N-propan-2-yl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586045
N-(3-methylbutyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 61062823
N-[4-(cyanomethyl)phenyl]-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31775100
2,2-dimethyl-N-[3-(trifluoromethoxy)phenyl]propanamide
CID 60725225
N-(2,4-dimethylphenyl)-2-(3-methoxyanilino)acetamide
CID 7636776
N-(3-chloro-4-cyanophenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31774526
2-(2,2,2-trifluoroethylamino)-N-[3-(trifluoromethoxy)phenyl]acetamide
CID 78924197

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide?
The IUPAC name of N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide (CID 31773766) is N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide.
What is the SMILES notation for N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide?
The canonical SMILES for N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide is Cc1ccccc1NC(=O)CNc1cccc(OC(F)(F)F)c1.
What is the InChIKey of N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide?
The InChIKey is VJRKYPSYVLSNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O2/c1-11-5-2-3-8-14(11)21-15(22)10-20-12-6-4-7-13(9-12)23-16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22).
What are the key properties of N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide?
N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide has a molecular weight of 324.30 g/mol, XLogP of 3.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide is sourced from PubChem (CID 31773766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).