N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide

C19H23NO2 — CID 100708090

IUPACN-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide
SMILESCOc1ccc(CCNC(=O)c2cc(C)c(C)cc2C)cc1
InChIInChI=1S/C19H23NO2/c1-13-11-15(3)18(12-14(13)2)19(21)20-10-9-16-5-7-17(22-4)8-6-16/h5-8,11-12H,9-10H2,1-4H3,(H,20,21)
InChIKeyQYIBSDJXXPOTIM-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.59
Rot. Bonds5

About N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide

N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide (PubChem CID 100708090) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide
PubChem CID100708090
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide
SMILESCOc1ccc(CCNC(=O)c2cc(C)c(C)cc2C)cc1
InChIInChI=1S/C19H23NO2/c1-13-11-15(3)18(12-14(13)2)19(21)20-10-9-16-5-7-17(22-4)8-6-16/h5-8,11-12H,9-10H2,1-4H3,(H,20,21)
InChIKeyQYIBSDJXXPOTIM-UHFFFAOYSA-N
XLogP3.59
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide 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-methoxyphenyl)propyl]-2,4,5-trimethylbenzamide
CID 84534524
2,5-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 18189798
N-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-1H-pyrrole-3-carboxamide
CID 110766148
5-chloro-2-fluoro-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 26586018
4-chloro-2-fluoro-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 26024473
4-[2-[(2,4-dimethoxybenzoyl)amino]ethyl]benzoic acid
CID 45347543
2,3-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 35509323
4-N-[2-(4-methoxyphenyl)ethyl]-1-N-propylbenzene-1,4-dicarboxamide
CID 109042916
N-[2-(4-methoxyphenyl)ethyl]naphthalene-2-carboxamide
CID 1343397
2-bromo-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 699177
N-[2-(4-methoxyphenyl)ethyl]-2-sulfanylbenzamide
CID 103601610
N-[2-(4-methoxyphenyl)ethyl]naphthalene-1-carboxamide
CID 2231008

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide?
The IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide (CID 100708090) is N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide is COc1ccc(CCNC(=O)c2cc(C)c(C)cc2C)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide?
The InChIKey is QYIBSDJXXPOTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-13-11-15(3)18(12-14(13)2)19(21)20-10-9-16-5-7-17(22-4)8-6-16/h5-8,11-12H,9-10H2,1-4H3,(H,20,21).
What are the key properties of N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide?
N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide has a molecular weight of 297.40 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)ethyl]-2,4,5-trimethylbenzamide is sourced from PubChem (CID 100708090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).