2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide

C17H19NO3 — CID 743463

IUPAC2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NCc1ccc(C)cc1
InChIInChI=1S/C17H19NO3/c1-12-7-9-13(10-8-12)11-18-17(19)16-14(20-2)5-4-6-15(16)21-3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyRQVRMZVQEFUTQF-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.94
Rot. Bonds5

About 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide

2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide (PubChem CID 743463) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
PubChem CID743463
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NCc1ccc(C)cc1
InChIInChI=1S/C17H19NO3/c1-12-7-9-13(10-8-12)11-18-17(19)16-14(20-2)5-4-6-15(16)21-3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyRQVRMZVQEFUTQF-UHFFFAOYSA-N
XLogP2.94
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide 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-fluorophenyl)methyl]-2,6-dimethoxybenzamide
CID 5216116
2,6-dimethoxy-N-[(4-methoxy-3-methylphenyl)methyl]benzamide
CID 110779766
5-[[(2,6-dimethoxybenzoyl)amino]methyl]-2-methoxybenzoic acid
CID 45384674
2,6-difluoro-N-[(4-methylphenyl)methyl]benzamide
CID 8781288
2-(2,3-dimethoxyphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 112978354
2,6-dimethoxy-N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]benzamide
CID 94249254
3-[[(2,6-dimethoxybenzoyl)amino]methyl]benzoic acid
CID 108767636
N'-[(2-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]propanediamide
CID 108945706
1-(2-methoxyphenyl)-3-[(4-methylphenyl)methyl]urea
CID 3723719
N-[(3-chloro-4-fluorophenyl)methyl]-2,6-dimethoxybenzamide
CID 110784344
2,6-dimethoxy-N-[[4-(4-phenyl-1,3-thiazol-2-yl)phenyl]methyl]benzamide
CID 108762322
2,6-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666083

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide (CID 743463) is 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide is COc1cccc(OC)c1C(=O)NCc1ccc(C)cc1.
What is the InChIKey of 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide?
The InChIKey is RQVRMZVQEFUTQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-12-7-9-13(10-8-12)11-18-17(19)16-14(20-2)5-4-6-15(16)21-3/h4-10H,11H2,1-3H3,(H,18,19).
What are the key properties of 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide?
2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide has a molecular weight of 285.34 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide is sourced from PubChem (CID 743463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).