Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-

C15H12F3NO2 — CID 846634

IUPACN-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide
SMILESCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F
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
LogP2.90
Rot. Bonds3

About Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-

Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)- (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 NameBenzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-
PubChem CID846634
Molecular FormulaC15H12F3NO2
Molecular Weight295.26 g/mol
Exact Mass295.08
IUPAC NameN-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide
SMILESCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F
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
XLogP2.90
TPSA38.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity359

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.26
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 248372
7-Methoxy-2-phenyl-quinolin-4-ol
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Frequently Asked Questions

What is the IUPAC name of Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-?
The IUPAC name of Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)- (CID 846634) is N-(3-methoxyphenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-?
The canonical SMILES for Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)- is COC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F.
What is the InChIKey of Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-?
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 Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)-?
Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)- has a molecular weight of 295.26 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for Benzamide, N-(3-methoxyphenyl)-2-(trifluoromethyl)- is sourced from PubChem (CID 846634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).