4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

C19H23NO5 — CID 41261598

IUPAC4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
SMILESCCOc1ccc(C(=O)NCc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C19H23NO5/c1-5-25-15-8-6-14(7-9-15)19(21)20-12-13-10-16(22-2)18(24-4)17(11-13)23-3/h6-11H,5,12H2,1-4H3,(H,20,21)
InChIKeyKQIIIEGRLCVYCM-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.04
Rot. Bonds8

About 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide (PubChem CID 41261598) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
PubChem CID41261598
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC Name4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
SMILESCCOc1ccc(C(=O)NCc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C19H23NO5/c1-5-25-15-8-6-14(7-9-15)19(21)20-12-13-10-16(22-2)18(24-4)17(11-13)23-3/h6-11H,5,12H2,1-4H3,(H,20,21)
InChIKeyKQIIIEGRLCVYCM-UHFFFAOYSA-N
XLogP3.04
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-diethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 41261631
4-(trifluoromethoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 41261622
4-ethoxy-N-[[4-[[(4-ethoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 3528873
4-(ethylsulfanylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 55875017
N-[(3,4,5-trimethoxyphenyl)methyl]naphthalene-2-carboxamide
CID 41261586
4-(methylsulfamoyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 26445094
4-[(E)-pent-1-enyl]-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 59811273
N-[(3-methoxy-4-propoxyphenyl)methyl]-4-propoxybenzamide
CID 54777018
N-[[4-(aminomethyl)phenyl]methyl]-4-ethoxybenzamide
CID 60918064
3,5-dichloro-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 17485942
N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methyl]-2,5-dimethoxybenzamide
CID 55892382
N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methyl]-1-oxidopyridin-1-ium-4-carboxamide
CID 60533347

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
The IUPAC name of 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide (CID 41261598) is 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide is CCOc1ccc(C(=O)NCc2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
The InChIKey is KQIIIEGRLCVYCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-5-25-15-8-6-14(7-9-15)19(21)20-12-13-10-16(22-2)18(24-4)17(11-13)23-3/h6-11H,5,12H2,1-4H3,(H,20,21).
What are the key properties of 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide has a molecular weight of 345.40 g/mol, XLogP of 3.04, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide is sourced from PubChem (CID 41261598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).