2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide

C23H22N2O3 — CID 113167416

IUPAC2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccccc1C
InChIInChI=1S/C23H22N2O3/c1-17-8-6-7-11-22(17)25(18(2)26)16-23(27)24-19-12-14-21(15-13-19)28-20-9-4-3-5-10-20/h3-15H,16H2,1-2H3,(H,24,27)
InChIKeyQPSHFXULWYONEA-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.78
Rot. Bonds6

About 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide

2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide (PubChem CID 113167416) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide
PubChem CID113167416
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccccc1C
InChIInChI=1S/C23H22N2O3/c1-17-8-6-7-11-22(17)25(18(2)26)16-23(27)24-19-12-14-21(15-13-19)28-20-9-4-3-5-10-20/h3-15H,16H2,1-2H3,(H,24,27)
InChIKeyQPSHFXULWYONEA-UHFFFAOYSA-N
XLogP4.78
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetyl-2-phenoxyanilino)-N-phenylacetamide
CID 113179233
2-(2-methyl-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide
CID 8574795
2-(N-acetyl-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 113167396
2-(N-acetyl-2-methylanilino)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 113167430
2-(N-acetyl-2,5-dimethylanilino)-N-phenylacetamide
CID 113168130
2-(N-acetyl-2-methylanilino)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 113167414
2-(2-methyl-N-methylsulfonylanilino)-N-(4-pyridin-4-yloxyphenyl)acetamide
CID 49363518
2-(N-acetyl-2,6-dimethylanilino)-N-(4-methoxyphenyl)acetamide
CID 113168753
2-(N-acetyl-2-ethylanilino)-N-phenylacetamide
CID 113169100
2-(N-acetyl-2-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113167394
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 113174308
2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 113170796

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide (CID 113167416) is 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccccc1C.
What is the InChIKey of 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide?
The InChIKey is QPSHFXULWYONEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-17-8-6-7-11-22(17)25(18(2)26)16-23(27)24-19-12-14-21(15-13-19)28-20-9-4-3-5-10-20/h3-15H,16H2,1-2H3,(H,24,27).
What are the key properties of 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide?
2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide has a molecular weight of 374.44 g/mol, XLogP of 4.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2-methylanilino)-N-(4-phenoxyphenyl)acetamide is sourced from PubChem (CID 113167416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).