N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide

C22H17F3N2O3 — CID 8873512

IUPACN-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide
SMILESCOc1ccccc1NC(=O)c1ccccc1NC(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C22H17F3N2O3/c1-30-19-12-5-4-11-18(19)27-21(29)16-9-2-3-10-17(16)26-20(28)14-7-6-8-15(13-14)22(23,24)25/h2-13H,1H3,(H,26,28)(H,27,29)
InChIKeyLEYWDKTWLOWJMS-UHFFFAOYSA-N
MW414.38 g/mol
LogP5.22
Rot. Bonds5

About N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide

N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide (PubChem CID 8873512) has the molecular formula C22H17F3N2O3 and a molecular weight of 414.38 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide
PubChem CID8873512
Molecular FormulaC22H17F3N2O3
Molecular Weight414.38 g/mol
Exact Mass414.12
IUPAC NameN-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide
SMILESCOc1ccccc1NC(=O)c1ccccc1NC(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C22H17F3N2O3/c1-30-19-12-5-4-11-18(19)27-21(29)16-9-2-3-10-17(16)26-20(28)14-7-6-8-15(13-14)22(23,24)25/h2-13H,1H3,(H,26,28)(H,27,29)
InChIKeyLEYWDKTWLOWJMS-UHFFFAOYSA-N
XLogP5.22
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.38
LogP ≤ 55.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethoxyphenyl)-3-(trifluoromethyl)benzamide
CID 531811
N-[2-(2-methylpropoxy)phenyl]-3-(trifluoromethyl)benzamide
CID 14405584
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
2-[(3-iodobenzoyl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 4107878
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] 3-(trifluoromethyl)benzoate
CID 7860096
N-(2-methoxyphenyl)-2-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxamide
CID 109269412
3-[[2-(2-methoxyanilino)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 54817220
N-(2-bromophenyl)-3-(trifluoromethyl)benzamide
CID 2561322
2,6-dimethoxy-N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]benzamide
CID 162047234
N-(2-propan-2-ylphenyl)-3-(trifluoromethyl)benzamide
CID 2678500
N-(2-methoxyphenyl)-4-[[(E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoyl]amino]benzamide
CID 2349234
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide
CID 871827

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide?
The IUPAC name of N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide (CID 8873512) is N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide is COc1ccccc1NC(=O)c1ccccc1NC(=O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide?
The InChIKey is LEYWDKTWLOWJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F3N2O3/c1-30-19-12-5-4-11-18(19)27-21(29)16-9-2-3-10-17(16)26-20(28)14-7-6-8-15(13-14)22(23,24)25/h2-13H,1H3,(H,26,28)(H,27,29).
What are the key properties of N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide?
N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide has a molecular weight of 414.38 g/mol, XLogP of 5.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide is sourced from PubChem (CID 8873512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).