N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide

C15H12F3NO2 — CID 846634

IUPACN-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide
SMILESCOc1cccc(NC(=O)c2ccccc2C(F)(F)F)c1
InChIInChI=1S/C15H12F3NO2/c1-21-11-6-4-5-10(9-11)19-14(20)12-7-2-3-8-13(12)15(16,17)18/h2-9H,1H3,(H,19,20)
InChIKeyGHNDCJFNRIXYPW-UHFFFAOYSA-N
MW295.26 g/mol
LogP3.97
Rot. Bonds3

About N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide

N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide (PubChem CID 846634) has the molecular formula C15H12F3NO2 and a molecular weight of 295.26 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide
PubChem CID846634
Molecular FormulaC15H12F3NO2
Molecular Weight295.26 g/mol
Exact Mass295.08
IUPAC NameN-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide
SMILESCOc1cccc(NC(=O)c2ccccc2C(F)(F)F)c1
InChIInChI=1S/C15H12F3NO2/c1-21-11-6-4-5-10(9-11)19-14(20)12-7-2-3-8-13(12)15(16,17)18/h2-9H,1H3,(H,19,20)
InChIKeyGHNDCJFNRIXYPW-UHFFFAOYSA-N
XLogP3.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.26
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Mepronil
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VU0357121
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N-(2-Aminophenyl)-4-methoxybenzamide
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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide (CID 846634) is N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide is COc1cccc(NC(=O)c2ccccc2C(F)(F)F)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide?
The InChIKey is GHNDCJFNRIXYPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO2/c1-21-11-6-4-5-10(9-11)19-14(20)12-7-2-3-8-13(12)15(16,17)18/h2-9H,1H3,(H,19,20).
What are the key properties of N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide?
N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide has a molecular weight of 295.26 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 846634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).