3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide

C19H23NO4 — CID 46479176

IUPAC3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
SMILESCCOc1cc(C(=O)NCc2cccc(COC)c2)ccc1OC
InChIInChI=1S/C19H23NO4/c1-4-24-18-11-16(8-9-17(18)23-3)19(21)20-12-14-6-5-7-15(10-14)13-22-2/h5-11H,4,12-13H2,1-3H3,(H,20,21)
InChIKeyWGEOXEPYZPHUPG-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.17
Rot. Bonds8

About 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide

3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide (PubChem CID 46479176) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
PubChem CID46479176
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
SMILESCCOc1cc(C(=O)NCc2cccc(COC)c2)ccc1OC
InChIInChI=1S/C19H23NO4/c1-4-24-18-11-16(8-9-17(18)23-3)19(21)20-12-14-6-5-7-15(10-14)13-22-2/h5-11H,4,12-13H2,1-3H3,(H,20,21)
InChIKeyWGEOXEPYZPHUPG-UHFFFAOYSA-N
XLogP3.17
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethoxy-4-methoxy-N-[(3-methoxyphenyl)methyl]benzamide
CID 38652199
N-[[3-[[(3,4-dimethoxybenzoyl)amino]methyl]phenyl]methyl]-3,4-dimethoxybenzamide
CID 2841934
N-[(3-chlorophenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 51158727
3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide
CID 39508576
3,4-diethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 41261631
N-benzyl-3-ethoxy-4-phenylmethoxybenzamide
CID 2192321
3-ethoxy-N-(furan-2-ylmethyl)-4-methoxybenzamide
CID 35808851
N-[(4-cyanophenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 46587460
3-bromo-5-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]-4-propoxybenzamide
CID 55717157
4-(difluoromethoxy)-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-3-ethoxybenzamide
CID 9261772
2-bromo-N-[[3-(methoxymethyl)phenyl]methyl]pyridine-4-carboxamide
CID 103752430
3-ethoxy-4-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 39045573

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide?
The IUPAC name of 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide (CID 46479176) is 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide?
The canonical SMILES for 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide is CCOc1cc(C(=O)NCc2cccc(COC)c2)ccc1OC.
What is the InChIKey of 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide?
The InChIKey is WGEOXEPYZPHUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-4-24-18-11-16(8-9-17(18)23-3)19(21)20-12-14-6-5-7-15(10-14)13-22-2/h5-11H,4,12-13H2,1-3H3,(H,20,21).
What are the key properties of 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide?
3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide has a molecular weight of 329.40 g/mol, XLogP of 3.17, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 46479176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).