N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide

C18H21NO4 — CID 46590246

IUPACN-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)NCc1ccc(OC)cc1OC
InChIInChI=1S/C18H21NO4/c1-4-23-16-8-6-5-7-15(16)18(20)19-12-13-9-10-14(21-2)11-17(13)22-3/h5-11H,4,12H2,1-3H3,(H,19,20)
InChIKeyAIMPQQPYDYALAS-UHFFFAOYSA-N
MW315.37 g/mol
LogP3.03
Rot. Bonds7

About N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide

N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide (PubChem CID 46590246) has the molecular formula C18H21NO4 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide.

Molecular Properties

Compound NameN-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide
PubChem CID46590246
Molecular FormulaC18H21NO4
Molecular Weight315.37 g/mol
Exact Mass315.15
IUPAC NameN-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)NCc1ccc(OC)cc1OC
InChIInChI=1S/C18H21NO4/c1-4-23-16-8-6-5-7-15(16)18(20)19-12-13-9-10-14(21-2)11-17(13)22-3/h5-11H,4,12H2,1-3H3,(H,19,20)
InChIKeyAIMPQQPYDYALAS-UHFFFAOYSA-N
XLogP3.03
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide 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-[(2,4-dimethoxyphenyl)methyl]-2-ethoxy-N-methylbenzamide
CID 18111735
N-[(3,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide
CID 17070136
N-[(2,4-dimethoxyphenyl)methyl]-2-iodo-3-methylbenzamide
CID 46453624
N-[(2,4-dimethoxyphenyl)methyl]-2,6-difluorobenzamide
CID 46590232
N-[(2,4-dimethoxyphenyl)methyl]-4-phenylbenzamide
CID 46590205
N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 38009470
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
N-[(2-ethoxyphenyl)methyl]-3-methoxy-4-methylbenzamide
CID 60565957
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
4-amino-N-[(2,4-dimethoxyphenyl)methyl]pyridine-3-carboxamide
CID 81235643
1-[(2,4-dimethoxyphenyl)methyl]-3-ethylurea
CID 47277960
N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide
CID 63257836

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide?
The IUPAC name of N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide (CID 46590246) is N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide.
What is the SMILES notation for N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide?
The canonical SMILES for N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide is CCOc1ccccc1C(=O)NCc1ccc(OC)cc1OC.
What is the InChIKey of N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide?
The InChIKey is AIMPQQPYDYALAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO4/c1-4-23-16-8-6-5-7-15(16)18(20)19-12-13-9-10-14(21-2)11-17(13)22-3/h5-11H,4,12H2,1-3H3,(H,19,20).
What are the key properties of N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide?
N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide has a molecular weight of 315.37 g/mol, XLogP of 3.03, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxybenzamide is sourced from PubChem (CID 46590246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).