N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide

C7H12N2O3 — CID 60700968

IUPACN-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCONC(=O)CN1CCCC1=O
InChIInChI=1S/C7H12N2O3/c1-12-8-6(10)5-9-4-2-3-7(9)11/h2-5H2,1H3,(H,8,10)
InChIKeyIASDHVIUJQHMGV-UHFFFAOYSA-N
MW172.18 g/mol
LogP-0.71
Rot. Bonds3

About N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide

N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 60700968) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID60700968
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC NameN-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCONC(=O)CN1CCCC1=O
InChIInChI=1S/C7H12N2O3/c1-12-8-6(10)5-9-4-2-3-7(9)11/h2-5H2,1H3,(H,8,10)
InChIKeyIASDHVIUJQHMGV-UHFFFAOYSA-N
XLogP-0.71
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide (CID 60700968) is N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide is CONC(=O)CN1CCCC1=O.
What is the InChIKey of N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is IASDHVIUJQHMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c1-12-8-6(10)5-9-4-2-3-7(9)11/h2-5H2,1H3,(H,8,10).
What are the key properties of N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 172.18 g/mol, XLogP of -0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 60700968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).