3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide

C17H18N2O3 — CID 17471157

IUPAC3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
SMILESCNC(=O)c1cccc(NC(=O)c2cccc(COC)c2)c1
InChIInChI=1S/C17H18N2O3/c1-18-16(20)14-7-4-8-15(10-14)19-17(21)13-6-3-5-12(9-13)11-22-2/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyOYLITDZFZPTWQM-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.44
Rot. Bonds5

About 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide

3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide (PubChem CID 17471157) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
PubChem CID17471157
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
SMILESCNC(=O)c1cccc(NC(=O)c2cccc(COC)c2)c1
InChIInChI=1S/C17H18N2O3/c1-18-16(20)14-7-4-8-15(10-14)19-17(21)13-6-3-5-12(9-13)11-22-2/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyOYLITDZFZPTWQM-UHFFFAOYSA-N
XLogP2.44
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide (CID 17471157) is 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide is CNC(=O)c1cccc(NC(=O)c2cccc(COC)c2)c1.
What is the InChIKey of 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide?
The InChIKey is OYLITDZFZPTWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-18-16(20)14-7-4-8-15(10-14)19-17(21)13-6-3-5-12(9-13)11-22-2/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide?
3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide has a molecular weight of 298.34 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 17471157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).