3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide

C21H15ClF3NO2 — CID 30155523

IUPAC3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1cccc(OCc2ccccc2Cl)c1
InChIInChI=1S/C21H15ClF3NO2/c22-18-10-3-1-6-15(18)13-28-16-8-5-7-14(12-16)20(27)26-19-11-4-2-9-17(19)21(23,24)25/h1-12H,13H2,(H,26,27)
InChIKeyHINGHJWDYMSPEA-UHFFFAOYSA-N
MW405.80 g/mol
LogP6.19
Rot. Bonds5

About 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide

3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide (PubChem CID 30155523) has the molecular formula C21H15ClF3NO2 and a molecular weight of 405.80 g/mol. Its IUPAC name is 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide
PubChem CID30155523
Molecular FormulaC21H15ClF3NO2
Molecular Weight405.80 g/mol
Exact Mass405.07
IUPAC Name3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1cccc(OCc2ccccc2Cl)c1
InChIInChI=1S/C21H15ClF3NO2/c22-18-10-3-1-6-15(18)13-28-16-8-5-7-14(12-16)20(27)26-19-11-4-2-9-17(19)21(23,24)25/h1-12H,13H2,(H,26,27)
InChIKeyHINGHJWDYMSPEA-UHFFFAOYSA-N
XLogP6.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.80
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 8813320
4-[(2-chlorophenyl)methoxy]-N-[4-chloro-2-(trifluoromethyl)phenyl]benzamide
CID 19916448
N-(2-chlorophenyl)-3-[(2-cyanophenyl)methoxy]benzamide
CID 52738882
1-[3-[(2-chlorophenyl)methoxy]phenyl]-2,2,2-trifluoroethanone
CID 83952238
3-[(2-chlorophenyl)methoxy]-N-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]benzamide
CID 100749756
3-[(2-chlorophenyl)methoxy]-N-(3-methoxyphenyl)benzamide
CID 30155561
3-[(2-chlorophenyl)methoxy]-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 100750034
3-[(2-chlorophenyl)methoxy]-N-prop-2-enylbenzamide
CID 30155712
methyl 3-[[3-[(2-chlorophenyl)methoxy]benzoyl]amino]-4-methoxybenzoate
CID 100749996
3-[(2-chlorophenyl)methoxy]-N-(6-methyl-2-pyridinyl)benzamide
CID 30155682
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-phenylmethoxybenzamide
CID 2288753
3-[(2-chlorophenyl)methoxy]-N,N-dimethylbenzamide
CID 13176467

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide (CID 30155523) is 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccccc1C(F)(F)F)c1cccc(OCc2ccccc2Cl)c1.
What is the InChIKey of 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide?
The InChIKey is HINGHJWDYMSPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClF3NO2/c22-18-10-3-1-6-15(18)13-28-16-8-5-7-14(12-16)20(27)26-19-11-4-2-9-17(19)21(23,24)25/h1-12H,13H2,(H,26,27).
What are the key properties of 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide?
3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide has a molecular weight of 405.80 g/mol, XLogP of 6.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chlorophenyl)methoxy]-N-[2-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 30155523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).