N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide

C23H22N2O5 — CID 55797225

IUPACN-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide
SMILESCOc1cc(OC)c(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)cc1OC
InChIInChI=1S/C23H22N2O5/c1-28-19-14-21(30-3)20(29-2)13-18(19)23(27)25-17-11-7-10-16(12-17)24-22(26)15-8-5-4-6-9-15/h4-14H,1-3H3,(H,24,26)(H,25,27)
InChIKeyMXDMCDWZDCSUPV-UHFFFAOYSA-N
MW406.44 g/mol
LogP4.22
Rot. Bonds7

About N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide

N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide (PubChem CID 55797225) has the molecular formula C23H22N2O5 and a molecular weight of 406.44 g/mol. Its IUPAC name is N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide.

Molecular Properties

Compound NameN-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide
PubChem CID55797225
Molecular FormulaC23H22N2O5
Molecular Weight406.44 g/mol
Exact Mass406.15
IUPAC NameN-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide
SMILESCOc1cc(OC)c(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)cc1OC
InChIInChI=1S/C23H22N2O5/c1-28-19-14-21(30-3)20(29-2)13-18(19)23(27)25-17-11-7-10-16(12-17)24-22(26)15-8-5-4-6-9-15/h4-14H,1-3H3,(H,24,26)(H,25,27)
InChIKeyMXDMCDWZDCSUPV-UHFFFAOYSA-N
XLogP4.22
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.44
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide 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

2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17403518
N-[(3-benzamidophenyl)carbamothioyl]-2,6-dimethoxybenzamide
CID 22780287
2,4,5-trimethoxy-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 4793592
N-[3-(dimethylsulfamoyl)phenyl]-2,4,5-trimethoxybenzamide
CID 9093791
2,4,5-trimethoxy-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 131950606
N-(3-amino-4-methoxyphenyl)benzamide;molecular nitrogen
CID 174994775
3,4,5-trimethoxy-N-[3-[(3,4,5-trimethoxybenzoyl)amino]phenyl]benzamide
CID 4578304
2-[[3-[(2-methoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 17341336
N-(3-fluorophenyl)-3-methoxynaphthalene-2-carboxamide
CID 802408
3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide
CID 5082074
N-(3-benzamidophenyl)-5-bromo-2-ethoxybenzamide
CID 17234910
N-[3-(ethylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 17439182

Frequently Asked Questions

What is the IUPAC name of N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide?
The IUPAC name of N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide (CID 55797225) is N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide.
What is the SMILES notation for N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide?
The canonical SMILES for N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide is COc1cc(OC)c(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)cc1OC.
What is the InChIKey of N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide?
The InChIKey is MXDMCDWZDCSUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O5/c1-28-19-14-21(30-3)20(29-2)13-18(19)23(27)25-17-11-7-10-16(12-17)24-22(26)15-8-5-4-6-9-15/h4-14H,1-3H3,(H,24,26)(H,25,27).
What are the key properties of N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide?
N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide has a molecular weight of 406.44 g/mol, XLogP of 4.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide is sourced from PubChem (CID 55797225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).