4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide

C18H21NO3 — CID 110761590

IUPAC4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
SMILESCOc1cc(C)c(C(=O)NCc2ccccc2OC)cc1C
InChIInChI=1S/C18H21NO3/c1-12-10-17(22-4)13(2)9-15(12)18(20)19-11-14-7-5-6-8-16(14)21-3/h5-10H,11H2,1-4H3,(H,19,20)
InChIKeySAAJQTRJZHQYDO-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.25
Rot. Bonds5

About 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide

4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide (PubChem CID 110761590) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide.

Molecular Properties

Compound Name4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
PubChem CID110761590
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
SMILESCOc1cc(C)c(C(=O)NCc2ccccc2OC)cc1C
InChIInChI=1S/C18H21NO3/c1-12-10-17(22-4)13(2)9-15(12)18(20)19-11-14-7-5-6-8-16(14)21-3/h5-10H,11H2,1-4H3,(H,19,20)
InChIKeySAAJQTRJZHQYDO-UHFFFAOYSA-N
XLogP3.25
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[(2-methoxyphenyl)methyl]-3-methylbenzamide
CID 17018061
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780829
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
2-methoxy-N-[(2-methoxyphenyl)methyl]-3,5-dimethylbenzamide
CID 110762822
5-chloro-2-fluoro-N-[(2-methoxyphenyl)methyl]benzamide
CID 26586354
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350
5-fluoro-2-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 31069159
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
2-iodo-N-[(2-methoxyphenyl)methyl]benzamide
CID 1378811
N-[(2-methoxyphenyl)methyl]-2-(2,4,5-trimethylphenoxy)acetamide
CID 112978023
N-[(2-ethoxyphenyl)methyl]-3-methoxy-4-methylbenzamide
CID 60565957
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide?
The IUPAC name of 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide (CID 110761590) is 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide.
What is the SMILES notation for 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide?
The canonical SMILES for 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide is COc1cc(C)c(C(=O)NCc2ccccc2OC)cc1C.
What is the InChIKey of 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide?
The InChIKey is SAAJQTRJZHQYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-12-10-17(22-4)13(2)9-15(12)18(20)19-11-14-7-5-6-8-16(14)21-3/h5-10H,11H2,1-4H3,(H,19,20).
What are the key properties of 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide?
4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide has a molecular weight of 299.37 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide is sourced from PubChem (CID 110761590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).