N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide

C16H21N3O3 — CID 138034380

IUPACN-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide
SMILESCC(=O)Nc1ccc(CCNC(=O)CC2CCC(=O)N2)cc1
InChIInChI=1S/C16H21N3O3/c1-11(20)18-13-4-2-12(3-5-13)8-9-17-16(22)10-14-6-7-15(21)19-14/h2-5,14H,6-10H2,1H3,(H,17,22)(H,18,20)(H,19,21)
InChIKeyWFOUHHZLQGWABL-UHFFFAOYSA-N
MW303.36 g/mol
LogP0.97
Rot. Bonds6

About N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide

N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide (PubChem CID 138034380) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide
PubChem CID138034380
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC NameN-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide
SMILESCC(=O)Nc1ccc(CCNC(=O)CC2CCC(=O)N2)cc1
InChIInChI=1S/C16H21N3O3/c1-11(20)18-13-4-2-12(3-5-13)8-9-17-16(22)10-14-6-7-15(21)19-14/h2-5,14H,6-10H2,1H3,(H,17,22)(H,18,20)(H,19,21)
InChIKeyWFOUHHZLQGWABL-UHFFFAOYSA-N
XLogP0.97
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 50.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-acetamidophenyl)ethyl]-2,5-dimethylpiperidine-1-carboxamide
CID 71868348
N-[2-(4-acetamidophenyl)ethyl]piperidine-4-carboxamide
CID 119307270
4-[2-(4-acetamidophenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673195
2-(4-acetamidoanilino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 109000569
2-(4-acetamidophenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 2461039
N-[2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 61371395
2-(4-acetamidophenyl)-N-(6-oxopiperidin-3-yl)acetamide
CID 62898113
N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 61371571
methyl 2-[2-(4-acetamidophenyl)ethylamino]acetate
CID 165487144
N-[2-(4-acetamidophenyl)ethyl]-1-aminocyclopentane-1-carboxamide
CID 119307278
N-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
2-(4-acetamidophenyl)-N-[2-(4-nitrophenyl)ethyl]acetamide
CID 14180969

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide?
The IUPAC name of N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide (CID 138034380) is N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide.
What is the SMILES notation for N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide?
The canonical SMILES for N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide is CC(=O)Nc1ccc(CCNC(=O)CC2CCC(=O)N2)cc1.
What is the InChIKey of N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide?
The InChIKey is WFOUHHZLQGWABL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-11(20)18-13-4-2-12(3-5-13)8-9-17-16(22)10-14-6-7-15(21)19-14/h2-5,14H,6-10H2,1H3,(H,17,22)(H,18,20)(H,19,21).
What are the key properties of N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide?
N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide has a molecular weight of 303.36 g/mol, XLogP of 0.97, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-acetamidophenyl)ethyl]-2-(5-oxopyrrolidin-2-yl)acetamide is sourced from PubChem (CID 138034380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).