2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide

C24H24N2O3 — CID 113167614

IUPAC2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(OCc2ccccc2)cc1)c1cccc(C)c1
InChIInChI=1S/C24H24N2O3/c1-18-7-6-10-22(15-18)26(19(2)27)16-24(28)25-21-11-13-23(14-12-21)29-17-20-8-4-3-5-9-20/h3-15H,16-17H2,1-2H3,(H,25,28)
InChIKeyVGAVARITAORCHB-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.57
Rot. Bonds7

About 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide

2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide (PubChem CID 113167614) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide
PubChem CID113167614
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(OCc2ccccc2)cc1)c1cccc(C)c1
InChIInChI=1S/C24H24N2O3/c1-18-7-6-10-22(15-18)26(19(2)27)16-24(28)25-21-11-13-23(14-12-21)29-17-20-8-4-3-5-9-20/h3-15H,16-17H2,1-2H3,(H,25,28)
InChIKeyVGAVARITAORCHB-UHFFFAOYSA-N
XLogP4.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methyl-N-methylsulfonylanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 51342544
2-(N-acetyl-4-phenylmethoxyanilino)-N-(4-cyanophenyl)acetamide
CID 113177559
2-(3-methylphenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 113098761
2-(N-acetyl-3-methylanilino)-N-(4-bromophenyl)acetamide
CID 113167580
2-(N-acetyl-3-methylanilino)-N-(3-methoxyphenyl)acetamide
CID 113167583
2-[acetyl(benzyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113161318
2-[acetyl(tert-butyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113166215
N-[4-[(3-methylphenyl)methoxy]phenyl]acetamide
CID 8522252
2-(N-acetyl-3-methylanilino)-N-(3-chlorophenyl)acetamide
CID 113167570
2-[acetyl(cyclopentyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113159367
2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113160544
3-(N-acetyl-3-methylanilino)-N-(4-methoxyphenyl)propanamide
CID 113123854

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide (CID 113167614) is 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(OCc2ccccc2)cc1)c1cccc(C)c1.
What is the InChIKey of 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide?
The InChIKey is VGAVARITAORCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-18-7-6-10-22(15-18)26(19(2)27)16-24(28)25-21-11-13-23(14-12-21)29-17-20-8-4-3-5-9-20/h3-15H,16-17H2,1-2H3,(H,25,28).
What are the key properties of 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide?
2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide has a molecular weight of 388.47 g/mol, XLogP of 4.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-methylanilino)-N-(4-phenylmethoxyphenyl)acetamide is sourced from PubChem (CID 113167614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).