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

C24H25NO4 — CID 39508576

IUPAC3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide
SMILESCCOc1cc(C(=O)NCc2ccc(COc3ccccc3)cc2)ccc1OC
InChIInChI=1S/C24H25NO4/c1-3-28-23-15-20(13-14-22(23)27-2)24(26)25-16-18-9-11-19(12-10-18)17-29-21-7-5-4-6-8-21/h4-15H,3,16-17H2,1-2H3,(H,25,26)
InChIKeyCDDNYBAOKJTPMA-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.60
Rot. Bonds9

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

3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide (PubChem CID 39508576) has the molecular formula C24H25NO4 and a molecular weight of 391.47 g/mol. Its IUPAC name is 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide
PubChem CID39508576
Molecular FormulaC24H25NO4
Molecular Weight391.47 g/mol
Exact Mass391.18
IUPAC Name3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide
SMILESCCOc1cc(C(=O)NCc2ccc(COc3ccccc3)cc2)ccc1OC
InChIInChI=1S/C24H25NO4/c1-3-28-23-15-20(13-14-22(23)27-2)24(26)25-16-18-9-11-19(12-10-18)17-29-21-7-5-4-6-8-21/h4-15H,3,16-17H2,1-2H3,(H,25,26)
InChIKeyCDDNYBAOKJTPMA-UHFFFAOYSA-N
XLogP4.60
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide 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-[(3,4-dimethoxyphenyl)methyl]-4-(phenoxymethyl)benzamide
CID 112789277
N-benzyl-3-ethoxy-4-phenylmethoxybenzamide
CID 2192321
3-ethoxy-4-methoxy-N-[(3-methoxyphenyl)methyl]benzamide
CID 38652199
N-[(4-cyanophenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 46587460
3-ethoxy-4-methoxy-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
CID 46479176
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenoxymethyl)benzamide
CID 26733446
N-benzyl-3-ethoxy-4-propoxybenzamide
CID 4264811
N-[(3-chlorophenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 51158727
3,4-diethoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 41261631
4-ethoxy-3-fluoro-N-[(4-methoxyphenyl)methyl]benzamide
CID 110762214
N'-(4-ethoxybenzoyl)-3-methoxy-4-phenylmethoxybenzohydrazide
CID 9492724
4-ethoxy-3-methoxy-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 24575944

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide?
The IUPAC name of 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide (CID 39508576) is 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide?
The canonical SMILES for 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide is CCOc1cc(C(=O)NCc2ccc(COc3ccccc3)cc2)ccc1OC.
What is the InChIKey of 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide?
The InChIKey is CDDNYBAOKJTPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO4/c1-3-28-23-15-20(13-14-22(23)27-2)24(26)25-16-18-9-11-19(12-10-18)17-29-21-7-5-4-6-8-21/h4-15H,3,16-17H2,1-2H3,(H,25,26).
What are the key properties of 3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide?
3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide has a molecular weight of 391.47 g/mol, XLogP of 4.60, 9 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-[[4-(phenoxymethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 39508576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).