2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide

C20H26N2O4 — CID 54813974

IUPAC2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
SMILESCOc1ccc(OC)c(NCC(=O)Nc2cccc(OCC(C)C)c2)c1
InChIInChI=1S/C20H26N2O4/c1-14(2)13-26-17-7-5-6-15(10-17)22-20(23)12-21-18-11-16(24-3)8-9-19(18)25-4/h5-11,14,21H,12-13H2,1-4H3,(H,22,23)
InChIKeyNIXKMMBJEATVQS-UHFFFAOYSA-N
MW358.44 g/mol
LogP3.79
Rot. Bonds9

About 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide

2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide (PubChem CID 54813974) has the molecular formula C20H26N2O4 and a molecular weight of 358.44 g/mol. Its IUPAC name is 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
PubChem CID54813974
Molecular FormulaC20H26N2O4
Molecular Weight358.44 g/mol
Exact Mass358.19
IUPAC Name2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
SMILESCOc1ccc(OC)c(NCC(=O)Nc2cccc(OCC(C)C)c2)c1
InChIInChI=1S/C20H26N2O4/c1-14(2)13-26-17-7-5-6-15(10-17)22-20(23)12-21-18-11-16(24-3)8-9-19(18)25-4/h5-11,14,21H,12-13H2,1-4H3,(H,22,23)
InChIKeyNIXKMMBJEATVQS-UHFFFAOYSA-N
XLogP3.79
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide 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

2-(2,5-dimethoxyanilino)-N-[3-(3-methylbutoxy)phenyl]acetamide
CID 54814025
2-(2,5-dimethoxyanilino)-N-(3-propan-2-yloxyphenyl)acetamide
CID 54813924
2-(2,5-dimethoxyanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54814109
N-(2,5-dimethoxyphenyl)-2-[2-(2-methylpropoxy)anilino]acetamide
CID 54823911
N-(2-methoxyphenyl)-2-[3-(2-methylpropoxy)anilino]acetamide
CID 54823826
2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54810289
N-[3-(2-methoxyethoxy)phenyl]-2-[2-(2-methylpropoxy)anilino]acetamide
CID 54823718
2-(2-bromoanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54816652
2-(3-acetamidoanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54831499
2-(3-ethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54826384
2-(2-methoxyphenoxy)-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 17079559
N-[4-[[2-(2,5-dimethoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54814052

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide?
The IUPAC name of 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide (CID 54813974) is 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide?
The canonical SMILES for 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide is COc1ccc(OC)c(NCC(=O)Nc2cccc(OCC(C)C)c2)c1.
What is the InChIKey of 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide?
The InChIKey is NIXKMMBJEATVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4/c1-14(2)13-26-17-7-5-6-15(10-17)22-20(23)12-21-18-11-16(24-3)8-9-19(18)25-4/h5-11,14,21H,12-13H2,1-4H3,(H,22,23).
What are the key properties of 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide?
2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide has a molecular weight of 358.44 g/mol, XLogP of 3.79, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyanilino)-N-[3-(2-methylpropoxy)phenyl]acetamide is sourced from PubChem (CID 54813974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).