1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide

C24H24N2O4 — CID 10111838

IUPAC1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
SMILESCOc1cccc(CNC(=O)c2cccc(C(=O)NCc3cccc(OC)c3)c2)c1
InChIInChI=1S/C24H24N2O4/c1-29-21-10-3-6-17(12-21)15-25-23(27)19-8-5-9-20(14-19)24(28)26-16-18-7-4-11-22(13-18)30-2/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyXDBOLPFDJWTESQ-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.56
Rot. Bonds8

About 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide

1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide (PubChem CID 10111838) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
PubChem CID10111838
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
SMILESCOc1cccc(CNC(=O)c2cccc(C(=O)NCc3cccc(OC)c3)c2)c1
InChIInChI=1S/C24H24N2O4/c1-29-21-10-3-6-17(12-21)15-25-23(27)19-8-5-9-20(14-19)24(28)26-16-18-7-4-11-22(13-18)30-2/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyXDBOLPFDJWTESQ-UHFFFAOYSA-N
XLogP3.56
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide 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

Cyclohexyl carbamic acid 3'-carbamoylbiphenyl-3-yl ester
CID 1383884
[3-(3-carbamoylphenyl)-4-methoxyphenyl] N-cyclohexylcarbamate
CID 71506769
N-((4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl)methyl)benzamide
CID 746156
N-(4-methoxyphenethyl)benzamide
CID 3083797
Benzamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071639
N-(4-methoxybenzyl)[1,1'-biphenyl]-4-carboxamide
CID 710674
N-[(4-methoxyphenyl)methyl]-4-methylbenzamide
CID 720058
3-[({(1s,2r)-1-Benzyl-2-Hydroxy-3-[(3-Methoxybenzyl)amino]propyl}amino)(Hydroxy)methyl]-N,N-Dipropylbenzamide
CID 449107
N'-{(1s,2r)-1-(3,5-Difluorobenzyl)-2-Hydroxy-3-[(3-Methoxybenzyl)amino]propyl}-5-Methyl-N,N-Dipropylisophthalamide
CID 9916309
N~3~-{(1S,2R)-1-(3,5-Difluorobenzyl)-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-N~1~,N~1~-dipropylbenzene-1,3,5-tricarboxamide
CID 16129583
N-(3-(trifluoromethoxy)benzyl)-4-phenoxybenzamide
CID 44405454
[3-(3-carbamoylphenyl)-4-methylphenyl] N-cyclohexylcarbamate
CID 71511803

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide?
The IUPAC name of 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide (CID 10111838) is 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide.
What is the SMILES notation for 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide?
The canonical SMILES for 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide is COc1cccc(CNC(=O)c2cccc(C(=O)NCc3cccc(OC)c3)c2)c1.
What is the InChIKey of 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide?
The InChIKey is XDBOLPFDJWTESQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-29-21-10-3-6-17(12-21)15-25-23(27)19-8-5-9-20(14-19)24(28)26-16-18-7-4-11-22(13-18)30-2/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide?
1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide has a molecular weight of 404.47 g/mol, XLogP of 3.56, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N-bis[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide is sourced from PubChem (CID 10111838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).