N-benzyl-2-(trifluoromethoxy)benzamide

C15H12F3NO2 — CID 174848356

IUPACN-benzyl-2-(trifluoromethoxy)benzamide
SMILESO=C(NCc1ccccc1)c1ccccc1OC(F)(F)F
InChIInChI=1S/C15H12F3NO2/c16-15(17,18)21-13-9-5-4-8-12(13)14(20)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,19,20)
InChIKeyVZGRXYFTBCNZKO-UHFFFAOYSA-N
MW295.26 g/mol
LogP3.52
Rot. Bonds4

About N-benzyl-2-(trifluoromethoxy)benzamide

N-benzyl-2-(trifluoromethoxy)benzamide (PubChem CID 174848356) has the molecular formula C15H12F3NO2 and a molecular weight of 295.26 g/mol. Its IUPAC name is N-benzyl-2-(trifluoromethoxy)benzamide.

Molecular Properties

Compound NameN-benzyl-2-(trifluoromethoxy)benzamide
PubChem CID174848356
Molecular FormulaC15H12F3NO2
Molecular Weight295.26 g/mol
Exact Mass295.08
IUPAC NameN-benzyl-2-(trifluoromethoxy)benzamide
SMILESO=C(NCc1ccccc1)c1ccccc1OC(F)(F)F
InChIInChI=1S/C15H12F3NO2/c16-15(17,18)21-13-9-5-4-8-12(13)14(20)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,19,20)
InChIKeyVZGRXYFTBCNZKO-UHFFFAOYSA-N
XLogP3.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.26
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-[[[2-(trifluoromethoxy)benzoyl]amino]methyl]phenyl]boronic acid
CID 140784412
N-benzyl-2-(difluoromethoxy)benzamide
CID 40548463
N-benzyl-2-[[4-[[2-(benzylcarbamoyl)phenoxy]methyl]phenyl]methoxy]benzamide
CID 101339913
N-benzyl-2-[[4-[[2-(benzylcarbamoyl)phenoxy]methyl]naphthalen-1-yl]methoxy]benzamide
CID 101429178
2-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 33311555
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(trifluoromethoxy)benzamide
CID 75515842
N-benzyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]benzamide
CID 7981561
1-[[[2-(trifluoromethoxy)benzoyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 120543771
N-benzyl-3-(trifluoromethoxy)benzamide
CID 175307745
N-(3-azabicyclo[3.1.0]hexan-6-ylmethyl)-2-(trifluoromethoxy)benzamide
CID 69470093
N-[[3-(4-fluoro-2-hydroxyphenyl)-1H-pyrazol-5-yl]methyl]-2-(trifluoromethoxy)benzamide
CID 166635995
1-N,2-N,3-N-tribenzylbenzene-1,2,3-tricarboxamide
CID 70015173

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(trifluoromethoxy)benzamide?
The IUPAC name of N-benzyl-2-(trifluoromethoxy)benzamide (CID 174848356) is N-benzyl-2-(trifluoromethoxy)benzamide.
What is the SMILES notation for N-benzyl-2-(trifluoromethoxy)benzamide?
The canonical SMILES for N-benzyl-2-(trifluoromethoxy)benzamide is O=C(NCc1ccccc1)c1ccccc1OC(F)(F)F.
What is the InChIKey of N-benzyl-2-(trifluoromethoxy)benzamide?
The InChIKey is VZGRXYFTBCNZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO2/c16-15(17,18)21-13-9-5-4-8-12(13)14(20)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,19,20).
What are the key properties of N-benzyl-2-(trifluoromethoxy)benzamide?
N-benzyl-2-(trifluoromethoxy)benzamide has a molecular weight of 295.26 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(trifluoromethoxy)benzamide is sourced from PubChem (CID 174848356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).