N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide

C13H16N2O3 — CID 550974

IUPACN-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
SMILESCOc1ccccc1NC(=O)C(=O)N1CCCC1
InChIInChI=1S/C13H16N2O3/c1-18-11-7-3-2-6-10(11)14-12(16)13(17)15-8-4-5-9-15/h2-3,6-7H,4-5,8-9H2,1H3,(H,14,16)
InChIKeyQYQVBGWDHQUXNU-UHFFFAOYSA-N
MW248.28 g/mol
LogP1.26
Rot. Bonds2

About N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide

N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide (PubChem CID 550974) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
PubChem CID550974
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC NameN-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
SMILESCOc1ccccc1NC(=O)C(=O)N1CCCC1
InChIInChI=1S/C13H16N2O3/c1-18-11-7-3-2-6-10(11)14-12(16)13(17)15-8-4-5-9-15/h2-3,6-7H,4-5,8-9H2,1H3,(H,14,16)
InChIKeyQYQVBGWDHQUXNU-UHFFFAOYSA-N
XLogP1.26
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-(azepan-1-yl)-N-(2-methoxy-4-nitrophenyl)-2-oxoacetamide
CID 108512934
N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide
CID 108517303
N-(2-methoxyphenyl)-4-(piperidine-1-carbonyl)piperidine-1-carboxamide
CID 27869689
3-(azepane-1-carbonyl)-N-(2-methoxyphenyl)benzamide
CID 109056708
(3S)-1-N-(2-methoxyphenyl)piperidine-1,3-dicarboxamide
CID 7372009
2-(azepan-1-yl)-N-(2,3-dimethylphenyl)-2-oxoacetamide
CID 47335483
1-acetyl-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 6468496
2-morpholin-4-yl-2-oxo-N-(2-propan-2-yloxyphenyl)acetamide
CID 108984286
2-(azepan-1-yl)-N-(3-chloro-2-methylphenyl)-2-oxoacetamide
CID 47335495
(3S)-1-(2,2-dimethylpropanoyl)-N-(2-methoxyphenyl)piperidine-3-carboxamide
CID 94857559
N-(2-methoxyphenyl)oxazinane-2-carboxamide
CID 113415280
1-(2-methoxyphenyl)-3-[(2R)-2-piperidin-1-ylpropyl]urea
CID 42473211

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide (CID 550974) is N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide is COc1ccccc1NC(=O)C(=O)N1CCCC1.
What is the InChIKey of N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
The InChIKey is QYQVBGWDHQUXNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-18-11-7-3-2-6-10(11)14-12(16)13(17)15-8-4-5-9-15/h2-3,6-7H,4-5,8-9H2,1H3,(H,14,16).
What are the key properties of N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide has a molecular weight of 248.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 550974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).