2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid

C7H14N2O6S — CID 175196309

IUPAC2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid
SMILESCS(=O)(=O)O.NC(=O)CN1CC(O)CC1=O
InChIInChI=1S/C6H10N2O3.CH4O3S/c7-5(10)3-8-2-4(9)1-6(8)11;1-5(2,3)4/h4,9H,1-3H2,(H2,7,10);1H3,(H,2,3,4)
InChIKeyZWZCBDSXBLPRGQ-UHFFFAOYSA-N
MW254.26 g/mol
LogP-2.43
Rot. Bonds2

About 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid

2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid (PubChem CID 175196309) has the molecular formula C7H14N2O6S and a molecular weight of 254.26 g/mol. Its IUPAC name is 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid.

Molecular Properties

Compound Name2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid
PubChem CID175196309
Molecular FormulaC7H14N2O6S
Molecular Weight254.26 g/mol
Exact Mass254.06
IUPAC Name2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid
SMILESCS(=O)(=O)O.NC(=O)CN1CC(O)CC1=O
InChIInChI=1S/C6H10N2O3.CH4O3S/c7-5(10)3-8-2-4(9)1-6(8)11;1-5(2,3)4/h4,9H,1-3H2,(H2,7,10);1H3,(H,2,3,4)
InChIKeyZWZCBDSXBLPRGQ-UHFFFAOYSA-N
XLogP-2.43
TPSA138.00 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 5-2.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

potassium;hydride;2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide
CID 174987008
sodium;chloro-(4-methylphenyl)sulfonylazanide;2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide
CID 88599824
methyl 2-[(4R)-4-hydroxy-2-oxopyrrolidin-1-yl]acetate
CID 86316250
3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide
CID 3052160
2-(4-hydroperoxy-2-oxopyrrolidin-1-yl)acetamide
CID 118704578
N-[2-[di(propan-2-yl)amino]ethyl]-2-[(4R)-4-hydroxy-2-oxopyrrolidin-1-yl]acetamide
CID 67942843
2-[4-(2,2-dihydroxypropyl)-2-oxopyrrolidin-1-yl]acetamide
CID 91411764
2-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]acetamide
CID 781884
2-[(4R)-2-oxo-4-phenylpyrrolidin-1-yl]acetamide;hydrochloride
CID 170974229
ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane
CID 153352892
4-hydroxy-1-[3-(2-hydroxyethylamino)propyl]pyrrolidin-2-one
CID 168702888
4-hydroxy-1-(3-trihydroxysilylpropyl)pyrrolidin-2-one
CID 168702894

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid?
The IUPAC name of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid (CID 175196309) is 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid.
What is the SMILES notation for 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid?
The canonical SMILES for 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid is CS(=O)(=O)O.NC(=O)CN1CC(O)CC1=O.
What is the InChIKey of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid?
The InChIKey is ZWZCBDSXBLPRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3.CH4O3S/c7-5(10)3-8-2-4(9)1-6(8)11;1-5(2,3)4/h4,9H,1-3H2,(H2,7,10);1H3,(H,2,3,4).
What are the key properties of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid?
2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid has a molecular weight of 254.26 g/mol, XLogP of -2.43, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide;methanesulfonic acid is sourced from PubChem (CID 175196309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).