5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide

C19H18N4O3 — CID 4736412

IUPAC5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide
SMILESCOc1ccccc1NC(=O)c1nc[nH]c1C(=O)NCc1ccccc1
InChIInChI=1S/C19H18N4O3/c1-26-15-10-6-5-9-14(15)23-19(25)17-16(21-12-22-17)18(24)20-11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,20,24)(H,21,22)(H,23,25)
InChIKeyKYBOBQPQYIKAEZ-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.60
Rot. Bonds6

About 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide

5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide (PubChem CID 4736412) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide.

Molecular Properties

Compound Name5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide
PubChem CID4736412
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide
SMILESCOc1ccccc1NC(=O)c1nc[nH]c1C(=O)NCc1ccccc1
InChIInChI=1S/C19H18N4O3/c1-26-15-10-6-5-9-14(15)23-19(25)17-16(21-12-22-17)18(24)20-11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,20,24)(H,21,22)(H,23,25)
InChIKeyKYBOBQPQYIKAEZ-UHFFFAOYSA-N
XLogP2.60
TPSA96.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-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

5-N-benzyl-4-N-(3-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide
CID 4736413
5-N-benzyl-4-N-(4-fluorophenyl)-1H-imidazole-4,5-dicarboxamide
CID 4736415
N-benzyl-5-methyl-1H-imidazole-4-carboxamide
CID 71320720
3-N-benzyl-5-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109105048
4-N-(1H-benzimidazol-2-yl)-5-N-[(3-methoxyphenyl)methyl]-1H-imidazole-4,5-dicarboxamide
CID 24985262
N-benzyl-3-methoxy-4-[2-(2-methoxyanilino)-2-oxoethoxy]benzamide
CID 9114511
5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109279891
N-benzyl-5-(2-methoxyanilino)pyrazine-2-carboxamide
CID 109279734
N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide
CID 110691757
N-benzyl-2-[(2-methoxybenzoyl)carbamothioylamino]benzamide
CID 4930662
3-hydroxy-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 54860878
1-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-N-(2-methoxyphenyl)-5-methyltriazole-4-carboxamide
CID 53366234

Frequently Asked Questions

What is the IUPAC name of 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide?
The IUPAC name of 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide (CID 4736412) is 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide.
What is the SMILES notation for 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide?
The canonical SMILES for 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide is COc1ccccc1NC(=O)c1nc[nH]c1C(=O)NCc1ccccc1.
What is the InChIKey of 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide?
The InChIKey is KYBOBQPQYIKAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-26-15-10-6-5-9-14(15)23-19(25)17-16(21-12-22-17)18(24)20-11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,20,24)(H,21,22)(H,23,25).
What are the key properties of 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide?
5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide has a molecular weight of 350.38 g/mol, XLogP of 2.60, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-benzyl-4-N-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxamide is sourced from PubChem (CID 4736412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).