3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide

C23H22N2O4 — CID 109056868

IUPAC3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(C(=O)Nc3ccccc3C)c2)c1
InChIInChI=1S/C23H22N2O4/c1-15-7-4-5-10-19(15)24-22(26)16-8-6-9-17(13-16)23(27)25-20-14-18(28-2)11-12-21(20)29-3/h4-14H,1-3H3,(H,24,26)(H,25,27)
InChIKeyZJCCHCIREBNMRL-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.52
Rot. Bonds6

About 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide

3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide (PubChem CID 109056868) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide
PubChem CID109056868
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(C(=O)Nc3ccccc3C)c2)c1
InChIInChI=1S/C23H22N2O4/c1-15-7-4-5-10-19(15)24-22(26)16-8-6-9-17(13-16)23(27)25-20-14-18(28-2)11-12-21(20)29-3/h4-14H,1-3H3,(H,24,26)(H,25,27)
InChIKeyZJCCHCIREBNMRL-UHFFFAOYSA-N
XLogP4.52
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049315
6-N-(2,5-dimethoxyphenyl)-2-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100075
N-(2,5-dimethoxyphenyl)naphthalene-2-carboxamide
CID 4011159
1-N-(2,4-dimethylphenyl)-3-N-(2-methoxy-5-methylphenyl)benzene-1,3-dicarboxamide
CID 109057155
N-(2,5-dimethoxyphenyl)-3-(trifluoromethyl)benzamide
CID 531811
N-(2,5-dimethoxyphenyl)-3,5-dimethylbenzamide
CID 918722
3-N-(2,6-dimethylphenyl)-1-N-(2-methoxy-5-methylphenyl)benzene-1,3-dicarboxamide
CID 109057247
3-bromo-4-methoxy-N-(2-methylphenyl)benzamide
CID 798203
N-(2,5-dimethoxyphenyl)-4-phenylbenzamide
CID 667706
3-N-cycloheptyl-1-N-(2,5-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109056122
4-methoxy-3-[(3-methoxybenzoyl)amino]-N-methylbenzamide
CID 87001832
3-N-(2,3-dimethylphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide
CID 109056848

Frequently Asked Questions

What is the IUPAC name of 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide?
The IUPAC name of 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide (CID 109056868) is 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide is COc1ccc(OC)c(NC(=O)c2cccc(C(=O)Nc3ccccc3C)c2)c1.
What is the InChIKey of 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide?
The InChIKey is ZJCCHCIREBNMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-15-7-4-5-10-19(15)24-22(26)16-8-6-9-17(13-16)23(27)25-20-14-18(28-2)11-12-21(20)29-3/h4-14H,1-3H3,(H,24,26)(H,25,27).
What are the key properties of 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide?
3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide has a molecular weight of 390.44 g/mol, XLogP of 4.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2,5-dimethoxyphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide is sourced from PubChem (CID 109056868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).