2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide

C25H28N2O3 — CID 54824046

IUPAC2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCC(C)COc1ccccc1NCC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C25H28N2O3/c1-19(2)17-30-24-11-7-6-10-23(24)26-16-25(28)27-21-12-14-22(15-13-21)29-18-20-8-4-3-5-9-20/h3-15,19,26H,16-18H2,1-2H3,(H,27,28)
InChIKeyZITHAZBLOCKLPM-UHFFFAOYSA-N
MW404.51 g/mol
LogP5.35
Rot. Bonds10

About 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide

2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide (PubChem CID 54824046) has the molecular formula C25H28N2O3 and a molecular weight of 404.51 g/mol. Its IUPAC name is 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
PubChem CID54824046
Molecular FormulaC25H28N2O3
Molecular Weight404.51 g/mol
Exact Mass404.21
IUPAC Name2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCC(C)COc1ccccc1NCC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C25H28N2O3/c1-19(2)17-30-24-11-7-6-10-23(24)26-16-25(28)27-21-12-14-22(15-13-21)29-18-20-8-4-3-5-9-20/h3-15,19,26H,16-18H2,1-2H3,(H,27,28)
InChIKeyZITHAZBLOCKLPM-UHFFFAOYSA-N
XLogP5.35
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.51
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)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-butoxyanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 54827744
N-[4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]phenyl]propanamide
CID 54823688
N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide
CID 54823920
N-[4-(3-methylbutoxy)phenyl]-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54826935
N-[4-(2-methylpropoxy)phenyl]-2-(naphthalen-1-ylamino)acetamide
CID 54809414
2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 37221138
N-[4-(2-methylpropoxy)phenyl]-4-phenylmethoxybenzamide
CID 4958406
2-(2-ethoxyanilino)-N-[4-(3-methylbutoxy)phenyl]acetamide
CID 54817368
2-(2,4-difluoroanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 109010754
4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]-N-propan-2-ylbenzamide
CID 54840386
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214
N-ethyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]-N-phenylbenzamide
CID 54823853

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
The IUPAC name of 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide (CID 54824046) is 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide.
What is the SMILES notation for 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
The canonical SMILES for 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide is CC(C)COc1ccccc1NCC(=O)Nc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
The InChIKey is ZITHAZBLOCKLPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O3/c1-19(2)17-30-24-11-7-6-10-23(24)26-16-25(28)27-21-12-14-22(15-13-21)29-18-20-8-4-3-5-9-20/h3-15,19,26H,16-18H2,1-2H3,(H,27,28).
What are the key properties of 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide has a molecular weight of 404.51 g/mol, XLogP of 5.35, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide is sourced from PubChem (CID 54824046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).