1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide

C10H18N2O4 — CID 10585545

IUPAC1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide
SMILESCOCCNC(=O)C1CCC(=O)N1CCO
InChIInChI=1S/C10H18N2O4/c1-16-7-4-11-10(15)8-2-3-9(14)12(8)5-6-13/h8,13H,2-7H2,1H3,(H,11,15)
InChIKeyZFKJIWSCQZPWMT-UHFFFAOYSA-N
MW230.26 g/mol
LogP-1.27
Rot. Bonds6

About 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide

1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 10585545) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID10585545
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide
SMILESCOCCNC(=O)C1CCC(=O)N1CCO
InChIInChI=1S/C10H18N2O4/c1-16-7-4-11-10(15)8-2-3-9(14)12(8)5-6-13/h8,13H,2-7H2,1H3,(H,11,15)
InChIKeyZFKJIWSCQZPWMT-UHFFFAOYSA-N
XLogP-1.27
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide (CID 10585545) is 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide is COCCNC(=O)C1CCC(=O)N1CCO.
What is the InChIKey of 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is ZFKJIWSCQZPWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-16-7-4-11-10(15)8-2-3-9(14)12(8)5-6-13/h8,13H,2-7H2,1H3,(H,11,15).
What are the key properties of 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide?
1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 230.26 g/mol, XLogP of -1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 10585545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).