N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide

C22H19ClN2O2 — CID 3539532

IUPACN-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C22H19ClN2O2/c1-25(2)18-11-8-16(9-12-18)22(27)24-20-13-10-17(23)14-19(20)21(26)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,24,27)
InChIKeyHSCCCROQJPOYSK-UHFFFAOYSA-N
MW378.86 g/mol
LogP4.89
Rot. Bonds5

About N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide

N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide (PubChem CID 3539532) has the molecular formula C22H19ClN2O2 and a molecular weight of 378.86 g/mol. Its IUPAC name is N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide
PubChem CID3539532
Molecular FormulaC22H19ClN2O2
Molecular Weight378.86 g/mol
Exact Mass378.11
IUPAC NameN-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C22H19ClN2O2/c1-25(2)18-11-8-16(9-12-18)22(27)24-20-13-10-17(23)14-19(20)21(26)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,24,27)
InChIKeyHSCCCROQJPOYSK-UHFFFAOYSA-N
XLogP4.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.86
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-benzamido-N-(2-benzoyl-4-chlorophenyl)-4-methylbenzamide
CID 17226391
N-(2-benzoyl-4-chlorophenyl)-4-ethylsulfanylbenzamide
CID 41044373
N-[4-chloro-2-(4-fluorobenzoyl)phenyl]-4-fluorobenzamide
CID 67505636
N-(2-benzoyl-4-chlorophenyl)-3-chloro-4-methoxybenzamide
CID 2296038
N-(2-benzoyl-4-chlorophenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 1326741
N-(2-benzoyl-4-chlorophenyl)-3,5-dichloro-4-methoxybenzamide
CID 4512455
N-(2-benzoyl-4-methylphenyl)-2,5-dichlorobenzamide
CID 23879994
N-(2-benzoyl-4-chlorophenyl)-4-morpholin-4-ylbenzamide
CID 21367719
N-(2-benzoyl-4-chlorophenyl)-2-methylpyrazole-3-carboxamide
CID 19475558
N-(2-benzoyl-4-chlorophenyl)-2-chloro-5-iodobenzamide
CID 2295317
N-(2-benzoyl-4-chlorophenyl)-2-iodoacetamide
CID 12500538
N-(2-benzoyl-4-chlorophenyl)-5-bromo-2,3,4-trimethylbenzamide
CID 3500532

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide?
The IUPAC name of N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide (CID 3539532) is N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide.
What is the SMILES notation for N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide?
The canonical SMILES for N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide is CN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)cc1.
What is the InChIKey of N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide?
The InChIKey is HSCCCROQJPOYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN2O2/c1-25(2)18-11-8-16(9-12-18)22(27)24-20-13-10-17(23)14-19(20)21(26)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,24,27).
What are the key properties of N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide?
N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide has a molecular weight of 378.86 g/mol, XLogP of 4.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-chlorophenyl)-4-(dimethylamino)benzamide is sourced from PubChem (CID 3539532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).