N,N-dibenzyl-3-ethoxy-4-methoxybenzamide

C24H25NO3 — CID 55334507

IUPACN,N-dibenzyl-3-ethoxy-4-methoxybenzamide
SMILESCCOc1cc(C(=O)N(Cc2ccccc2)Cc2ccccc2)ccc1OC
InChIInChI=1S/C24H25NO3/c1-3-28-23-16-21(14-15-22(23)27-2)24(26)25(17-19-10-6-4-7-11-19)18-20-12-8-5-9-13-20/h4-16H,3,17-18H2,1-2H3
InChIKeyZKJNNYJGGMMVSI-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.94
Rot. Bonds8

About N,N-dibenzyl-3-ethoxy-4-methoxybenzamide

N,N-dibenzyl-3-ethoxy-4-methoxybenzamide (PubChem CID 55334507) has the molecular formula C24H25NO3 and a molecular weight of 375.47 g/mol. Its IUPAC name is N,N-dibenzyl-3-ethoxy-4-methoxybenzamide.

Molecular Properties

Compound NameN,N-dibenzyl-3-ethoxy-4-methoxybenzamide
PubChem CID55334507
Molecular FormulaC24H25NO3
Molecular Weight375.47 g/mol
Exact Mass375.18
IUPAC NameN,N-dibenzyl-3-ethoxy-4-methoxybenzamide
SMILESCCOc1cc(C(=O)N(Cc2ccccc2)Cc2ccccc2)ccc1OC
InChIInChI=1S/C24H25NO3/c1-3-28-23-16-21(14-15-22(23)27-2)24(26)25(17-19-10-6-4-7-11-19)18-20-12-8-5-9-13-20/h4-16H,3,17-18H2,1-2H3
InChIKeyZKJNNYJGGMMVSI-UHFFFAOYSA-N
XLogP4.94
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dibenzyl-3-ethoxy-4-methoxybenzamide 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,N-dibenzyl-3,4-diethoxybenzamide
CID 73441726
N-benzyl-3-bromo-N-ethyl-4-methoxybenzamide
CID 60660630
3-amino-N-benzyl-4-ethoxy-N-(2,2,2-trifluoroethyl)benzamide
CID 113226067
N-benzyl-3,4-diethoxy-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide
CID 135875437
1,2-bis(3-ethoxy-4-methoxyphenyl)ethane-1,2-dione
CID 126457801
N-benzyl-3,4-dimethoxy-N-propan-2-ylbenzamide
CID 807482
N-benzyl-3-bromo-N-(2-cyanoethyl)-4-ethoxybenzamide
CID 43911773
N-ethyl-3,4-dimethoxy-N-(pyridin-4-ylmethyl)benzamide
CID 6470450
3-ethoxy-4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 134028026
N-benzyl-3,4-dimethoxy-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide
CID 135738075
N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-ethyl-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 24548570
N-benzyl-2-(3,4-dimethoxyanilino)-N-ethylpyrimidine-5-carboxamide
CID 109258399

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-3-ethoxy-4-methoxybenzamide?
The IUPAC name of N,N-dibenzyl-3-ethoxy-4-methoxybenzamide (CID 55334507) is N,N-dibenzyl-3-ethoxy-4-methoxybenzamide.
What is the SMILES notation for N,N-dibenzyl-3-ethoxy-4-methoxybenzamide?
The canonical SMILES for N,N-dibenzyl-3-ethoxy-4-methoxybenzamide is CCOc1cc(C(=O)N(Cc2ccccc2)Cc2ccccc2)ccc1OC.
What is the InChIKey of N,N-dibenzyl-3-ethoxy-4-methoxybenzamide?
The InChIKey is ZKJNNYJGGMMVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO3/c1-3-28-23-16-21(14-15-22(23)27-2)24(26)25(17-19-10-6-4-7-11-19)18-20-12-8-5-9-13-20/h4-16H,3,17-18H2,1-2H3.
What are the key properties of N,N-dibenzyl-3-ethoxy-4-methoxybenzamide?
N,N-dibenzyl-3-ethoxy-4-methoxybenzamide has a molecular weight of 375.47 g/mol, XLogP of 4.94, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-3-ethoxy-4-methoxybenzamide is sourced from PubChem (CID 55334507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).