N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide

C21H18ClNO2 — CID 4946400

IUPACN-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccccc1OCc1ccccc1
InChIInChI=1S/C21H18ClNO2/c1-15-11-12-17(22)13-19(15)23-21(24)18-9-5-6-10-20(18)25-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,24)
InChIKeyOZEAAMFFFODLIT-UHFFFAOYSA-N
MW351.83 g/mol
LogP5.48
Rot. Bonds5

About N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide

N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide (PubChem CID 4946400) has the molecular formula C21H18ClNO2 and a molecular weight of 351.83 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide
PubChem CID4946400
Molecular FormulaC21H18ClNO2
Molecular Weight351.83 g/mol
Exact Mass351.10
IUPAC NameN-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccccc1OCc1ccccc1
InChIInChI=1S/C21H18ClNO2/c1-15-11-12-17(22)13-19(15)23-21(24)18-9-5-6-10-20(18)25-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,24)
InChIKeyOZEAAMFFFODLIT-UHFFFAOYSA-N
XLogP5.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.83
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-methylphenyl)-2-(2-phenoxyethoxy)benzamide
CID 4954394
2-[[2-[(4-chlorophenyl)methoxy]benzoyl]amino]-N-methylbenzamide
CID 16566015
N-(2-chlorophenyl)-2-[(4-chlorophenyl)methoxy]benzamide
CID 7947681
N-(2-hydroxy-5-methylphenyl)-2-phenylmethoxybenzamide
CID 4946343
N-(2,5-dimethylphenyl)-2-(2-phenylethoxy)benzamide
CID 19628089
N-(5-chloro-2-methylphenyl)-2-phenylbenzamide
CID 976295
N-tert-butyl-2-phenylmethoxybenzamide
CID 4946348
methyl 3-[[2-[(2-methylphenyl)carbamoyl]phenoxy]methyl]benzoate
CID 2995814
3-[(2-ethoxybenzoyl)amino]-4-methylbenzoic acid
CID 16789136
N-(2-ethyl-6-methylphenyl)-2-phenylmethoxybenzamide
CID 4946399
benzyl N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]carbamate
CID 60596320
N-(2-hydroxyphenyl)-2-[(3-methylphenyl)methoxy]benzamide
CID 25494578

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide (CID 4946400) is N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide is Cc1ccc(Cl)cc1NC(=O)c1ccccc1OCc1ccccc1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide?
The InChIKey is OZEAAMFFFODLIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClNO2/c1-15-11-12-17(22)13-19(15)23-21(24)18-9-5-6-10-20(18)25-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,24).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide?
N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide has a molecular weight of 351.83 g/mol, XLogP of 5.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide is sourced from PubChem (CID 4946400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).