N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide

C21H15Cl2NO2 — CID 23879994

IUPACN-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2Cl)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C21H15Cl2NO2/c1-13-7-10-19(17(11-13)20(25)14-5-3-2-4-6-14)24-21(26)16-12-15(22)8-9-18(16)23/h2-12H,1H3,(H,24,26)
InChIKeyWDBCIQOGPRVQHW-UHFFFAOYSA-N
MW384.26 g/mol
LogP5.79
Rot. Bonds4

About N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide

N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide (PubChem CID 23879994) has the molecular formula C21H15Cl2NO2 and a molecular weight of 384.26 g/mol. Its IUPAC name is N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide
PubChem CID23879994
Molecular FormulaC21H15Cl2NO2
Molecular Weight384.26 g/mol
Exact Mass383.05
IUPAC NameN-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2Cl)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C21H15Cl2NO2/c1-13-7-10-19(17(11-13)20(25)14-5-3-2-4-6-14)24-21(26)16-12-15(22)8-9-18(16)23/h2-12H,1H3,(H,24,26)
InChIKeyWDBCIQOGPRVQHW-UHFFFAOYSA-N
XLogP5.79
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.26
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(2-benzoyl-4-methylphenyl)carbamoyl]phenyl]-2,4-dichlorobenzamide
CID 2342128
N-(2-benzoyl-4-chlorophenyl)-2-chloro-5-iodobenzamide
CID 2295317
N-(2-benzoyl-4-chlorophenyl)-2-chloro-5-nitrobenzamide
CID 1354566
N-(2-benzoyl-4-chlorophenyl)-5-bromo-2,3,4-trimethylbenzamide
CID 3500532
N-[2-[(2-benzoyl-4-methylphenyl)carbamoyl]phenyl]-2-methylbenzamide
CID 2313037
N-(2-benzoyl-4-methylphenyl)-2-(2-methylpropanoylamino)benzamide
CID 4829157
3-benzamido-N-(2-benzoyl-4-chlorophenyl)-4-methylbenzamide
CID 17226391
N-(2-benzoyl-4-chlorophenyl)-3,5-dichloro-4-methoxybenzamide
CID 4512455
1-(2-benzoyl-4-chlorophenyl)-3-(4-methylphenyl)thiourea
CID 100639453
N-(2-benzoyl-4-bromophenyl)-5-chloro-2-methoxybenzamide
CID 4546153
N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide
CID 3539532
2-[(2,4-dichlorobenzoyl)amino]-5-methylbenzoic acid
CID 4287647

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide?
The IUPAC name of N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide (CID 23879994) is N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide.
What is the SMILES notation for N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide?
The canonical SMILES for N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide is Cc1ccc(NC(=O)c2cc(Cl)ccc2Cl)c(C(=O)c2ccccc2)c1.
What is the InChIKey of N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide?
The InChIKey is WDBCIQOGPRVQHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15Cl2NO2/c1-13-7-10-19(17(11-13)20(25)14-5-3-2-4-6-14)24-21(26)16-12-15(22)8-9-18(16)23/h2-12H,1H3,(H,24,26).
What are the key properties of N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide?
N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide has a molecular weight of 384.26 g/mol, XLogP of 5.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide is sourced from PubChem (CID 23879994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).