N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide

C20H16ClNO2 — CID 956260

IUPACN-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1
InChIInChI=1S/C20H16ClNO2/c1-14-7-9-15(10-8-14)20(23)22-18-13-16(21)11-12-19(18)24-17-5-3-2-4-6-17/h2-13H,1H3,(H,22,23)
InChIKeyPBHOXAUMJWNZMR-UHFFFAOYSA-N
MW337.81 g/mol
LogP5.69
Rot. Bonds4

About N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide

N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide (PubChem CID 956260) has the molecular formula C20H16ClNO2 and a molecular weight of 337.81 g/mol. Its IUPAC name is N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide
PubChem CID956260
Molecular FormulaC20H16ClNO2
Molecular Weight337.81 g/mol
Exact Mass337.09
IUPAC NameN-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1
InChIInChI=1S/C20H16ClNO2/c1-14-7-9-15(10-8-14)20(23)22-18-13-16(21)11-12-19(18)24-17-5-3-2-4-6-17/h2-13H,1H3,(H,22,23)
InChIKeyPBHOXAUMJWNZMR-UHFFFAOYSA-N
XLogP5.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.81
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-phenoxyphenyl)benzamide
CID 956230
N-(5-chloro-2-phenoxyphenyl)-2,5-dimethylbenzamide
CID 100657509
N-(5-chloro-2-phenoxyphenyl)-4-prop-2-enoxybenzamide
CID 9172914
N-(5-chloro-2-phenoxyphenyl)-3-iodobenzamide
CID 100513507
N-[5-chloro-2-(4-methylphenoxy)phenyl]furan-3-carboxamide
CID 34131638
N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide
CID 30779619
N-(5-chloro-2-phenoxyphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydroindole-5-carboxamide
CID 100766221
N-(5-chloro-2-phenoxyphenyl)-4-[methylsulfonyl(prop-2-enyl)amino]benzamide
CID 2973027
N-[5-chloro-2-(4-methylphenoxy)phenyl]-6-oxo-1-phenylpyridazine-3-carboxamide
CID 52572154
(2S)-N-(5-chloro-2-phenoxyphenyl)-2-(2,4-dimethylphenoxy)propanamide
CID 9172968
N-[2-(4-benzoylphenoxy)-5-chlorophenyl]-2-(4-methylphenyl)sulfanylpyridine-3-carboxamide
CID 4841709
N-[5-chloro-2-(4-chlorophenoxy)phenyl]-4-(methylsulfonylmethyl)benzamide
CID 26250465

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide?
The IUPAC name of N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide (CID 956260) is N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide.
What is the SMILES notation for N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide?
The canonical SMILES for N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide is Cc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1.
What is the InChIKey of N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide?
The InChIKey is PBHOXAUMJWNZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClNO2/c1-14-7-9-15(10-8-14)20(23)22-18-13-16(21)11-12-19(18)24-17-5-3-2-4-6-17/h2-13H,1H3,(H,22,23).
What are the key properties of N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide?
N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide has a molecular weight of 337.81 g/mol, XLogP of 5.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-phenoxyphenyl)-4-methylbenzamide is sourced from PubChem (CID 956260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).