N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide

C22H19ClN2O4 — CID 17314016

IUPACN-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2)c(OC)c1
InChIInChI=1S/C22H19ClN2O4/c1-28-18-10-11-19(20(13-18)29-2)22(27)25-17-8-6-16(7-9-17)24-21(26)14-4-3-5-15(23)12-14/h3-13H,1-2H3,(H,24,26)(H,25,27)
InChIKeyJELJOGUJBJMVIN-UHFFFAOYSA-N
MW410.86 g/mol
LogP4.86
Rot. Bonds6

About N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide

N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide (PubChem CID 17314016) has the molecular formula C22H19ClN2O4 and a molecular weight of 410.86 g/mol. Its IUPAC name is N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide
PubChem CID17314016
Molecular FormulaC22H19ClN2O4
Molecular Weight410.86 g/mol
Exact Mass410.10
IUPAC NameN-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2)c(OC)c1
InChIInChI=1S/C22H19ClN2O4/c1-28-18-10-11-19(20(13-18)29-2)22(27)25-17-8-6-16(7-9-17)24-21(26)14-4-3-5-15(23)12-14/h3-13H,1-2H3,(H,24,26)(H,25,27)
InChIKeyJELJOGUJBJMVIN-UHFFFAOYSA-N
XLogP4.86
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.86
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,6-dimethoxybenzamide
CID 22775702
3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide
CID 46323153
3-[(2,4-dimethoxybenzoyl)amino]benzoate
CID 7375040
N-(3-chloro-4-fluorophenyl)-2,4-dimethoxybenzamide
CID 4674672
N-[4-[1-(3-chlorophenyl)-1-oxopropan-2-yl]oxyphenyl]-3-methoxybenzamide
CID 19645150
N'-(3-chlorobenzoyl)-2,5-dimethoxybenzohydrazide
CID 8637145
N-[3-[(3-chlorophenyl)sulfamoyl]-4-methylphenyl]-2,4-dimethoxybenzamide
CID 26774130
N-(4-ethoxyphenyl)-2,4-dimethoxybenzamide
CID 669318
2-chloro-5-[(2,4-dimethoxybenzoyl)amino]benzamide
CID 46570655
N-(3-chlorophenyl)-2-hydroxy-4-methoxybenzamide
CID 5274047
N-[4-[(1R)-1-hydroxyethyl]phenyl]-2,4-dimethoxybenzamide
CID 100803459
3-chloro-N-(4-methylphenyl)benzamide
CID 722375

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide?
The IUPAC name of N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide (CID 17314016) is N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2)c(OC)c1.
What is the InChIKey of N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide?
The InChIKey is JELJOGUJBJMVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN2O4/c1-28-18-10-11-19(20(13-18)29-2)22(27)25-17-8-6-16(7-9-17)24-21(26)14-4-3-5-15(23)12-14/h3-13H,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide?
N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide has a molecular weight of 410.86 g/mol, XLogP of 4.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide is sourced from PubChem (CID 17314016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).