N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide

C16H14F3NO2 — CID 7778212

IUPACN-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccccc1C(F)(F)F
InChIInChI=1S/C16H14F3NO2/c1-10-7-8-14(22-2)13(9-10)20-15(21)11-5-3-4-6-12(11)16(17,18)19/h3-9H,1-2H3,(H,20,21)
InChIKeyPQALYYGULOVWBT-UHFFFAOYSA-N
MW309.29 g/mol
LogP4.27
Rot. Bonds3

About N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide

N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide (PubChem CID 7778212) has the molecular formula C16H14F3NO2 and a molecular weight of 309.29 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide
PubChem CID7778212
Molecular FormulaC16H14F3NO2
Molecular Weight309.29 g/mol
Exact Mass309.10
IUPAC NameN-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccccc1C(F)(F)F
InChIInChI=1S/C16H14F3NO2/c1-10-7-8-14(22-2)13(9-10)20-15(21)11-5-3-4-6-12(11)16(17,18)19/h3-9H,1-2H3,(H,20,21)
InChIKeyPQALYYGULOVWBT-UHFFFAOYSA-N
XLogP4.27
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.29
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-benzamido-2,5-dimethoxyphenyl)-2-(trifluoromethyl)benzamide
CID 16551146
N-(2-methoxy-5-methylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 51283496
2-(difluoromethoxy)-N-(2-methoxy-5-methylphenyl)benzamide
CID 2441885
2-[[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 9286477
2-bromo-N-(2-methoxy-5-methylphenyl)-3-methylbenzamide
CID 103852727
N-(3-methylphenyl)-2-(trifluoromethyl)benzamide
CID 846758
2-(2-amino-2-oxoethoxy)-N-(2-methoxy-5-methylphenyl)benzamide
CID 9453585
N-(2-methoxy-5-methylphenyl)quinoxaline-5-carboxamide
CID 110701438
N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(trifluoromethyl)benzamide
CID 122323335
1-(2-tert-butylphenyl)-3-(2-methoxy-5-methylphenyl)urea
CID 108991730
2-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)benzamide
CID 7899789
N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide
CID 9208634

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide (CID 7778212) is N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide is COc1ccc(C)cc1NC(=O)c1ccccc1C(F)(F)F.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide?
The InChIKey is PQALYYGULOVWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO2/c1-10-7-8-14(22-2)13(9-10)20-15(21)11-5-3-4-6-12(11)16(17,18)19/h3-9H,1-2H3,(H,20,21).
What are the key properties of N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide?
N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide has a molecular weight of 309.29 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 7778212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).