N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide

C15H11ClF3NO2 — CID 871827

IUPACN-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
InChIInChI=1S/C15H11ClF3NO2/c1-22-13-5-3-2-4-10(13)14(21)20-12-8-9(15(17,18)19)6-7-11(12)16/h2-8H,1H3,(H,20,21)
InChIKeyJNTUIIWGUNMKDB-UHFFFAOYSA-N
MW329.71 g/mol
LogP4.62
Rot. Bonds3

About N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide (PubChem CID 871827) has the molecular formula C15H11ClF3NO2 and a molecular weight of 329.71 g/mol. Its IUPAC name is N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide
PubChem CID871827
Molecular FormulaC15H11ClF3NO2
Molecular Weight329.71 g/mol
Exact Mass329.04
IUPAC NameN-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl
InChIInChI=1S/C15H11ClF3NO2/c1-22-13-5-3-2-4-10(13)14(21)20-12-8-9(15(17,18)19)6-7-11(12)16/h2-8H,1H3,(H,20,21)
InChIKeyJNTUIIWGUNMKDB-UHFFFAOYSA-N
XLogP4.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.71
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-methoxybenzoyl)amino]-4-(trifluoromethyl)benzamide
CID 59299610
N-[2-amino-4-(trifluoromethyl)phenyl]-2-methoxybenzamide
CID 16775181
methyl 4-chloro-3-[(2-methoxybenzoyl)amino]benzoate
CID 926199
2-methoxy-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzamide
CID 1422102
2-butoxy-N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide
CID 54787028
methyl 4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoate
CID 54787072
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
N-[5-(butanoylamino)-2-chlorophenyl]-2-methoxybenzamide
CID 960096
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(dimethylamino)pyridine-3-carboxamide
CID 110299286
3-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]naphthalene-2-carboxamide
CID 20604816
N-(2-methoxyphenyl)-2-[[3-(trifluoromethyl)benzoyl]amino]benzamide
CID 8873512

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide?
The IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide (CID 871827) is N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide?
The canonical SMILES for N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1Cl.
What is the InChIKey of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide?
The InChIKey is JNTUIIWGUNMKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF3NO2/c1-22-13-5-3-2-4-10(13)14(21)20-12-8-9(15(17,18)19)6-7-11(12)16/h2-8H,1H3,(H,20,21).
What are the key properties of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide?
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide has a molecular weight of 329.71 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide is sourced from PubChem (CID 871827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).