2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide

C20H24N2O3 — CID 113161293

IUPAC2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(OC(C)C)cc1)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-15(2)25-19-11-9-18(10-12-19)21-20(24)14-22(16(3)23)13-17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3,(H,21,24)
InChIKeyUNKAEQQLRPJYFW-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.46
Rot. Bonds7

About 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide

2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide (PubChem CID 113161293) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide
PubChem CID113161293
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(OC(C)C)cc1)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-15(2)25-19-11-9-18(10-12-19)21-20(24)14-22(16(3)23)13-17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3,(H,21,24)
InChIKeyUNKAEQQLRPJYFW-UHFFFAOYSA-N
XLogP3.46
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[acetyl(benzyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113161318
2-[acetyl(prop-2-enyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide
CID 113158570
N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide
CID 113163156
2-[acetyl(pyridin-3-ylmethyl)amino]-N-(4-phenoxyphenyl)acetamide
CID 113163707
2-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]-N-(4-propan-2-yloxyphenyl)acetamide
CID 113164905
2-[acetyl(benzyl)amino]-N-(3-methoxyphenyl)acetamide
CID 113161287
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(4-methylphenyl)acetamide
CID 113163104
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(4-ethylphenyl)acetamide
CID 113163115
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 113174308
2-[acetyl-[(4-chlorophenyl)methyl]amino]-N-(4-chlorophenyl)acetamide
CID 113162786
3-oxo-N-(4-propan-2-yloxyphenyl)butanamide
CID 28969935
N-benzyl-N-[3-phenyl-3-(4-propan-2-yloxyphenyl)propyl]acetamide
CID 4610480

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide (CID 113161293) is 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(OC(C)C)cc1)Cc1ccccc1.
What is the InChIKey of 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide?
The InChIKey is UNKAEQQLRPJYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-15(2)25-19-11-9-18(10-12-19)21-20(24)14-22(16(3)23)13-17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3,(H,21,24).
What are the key properties of 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide?
2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.46, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(benzyl)amino]-N-(4-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 113161293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).