1-hydroxypyrrolidine-2,5-dione;hydrochloride

C4H6ClNO3 — CID 22138436

IUPAC1-hydroxypyrrolidine-2,5-dione;hydrochloride
SMILESCl.O=C1CCC(=O)N1O
InChIInChI=1S/C4H5NO3.ClH/c6-3-1-2-4(7)5(3)8;/h8H,1-2H2;1H
InChIKeyGOODXEAJZGMZKG-UHFFFAOYSA-N
MW151.55 g/mol
LogP-0.05
Rot. Bonds

About 1-hydroxypyrrolidine-2,5-dione;hydrochloride

1-hydroxypyrrolidine-2,5-dione;hydrochloride (PubChem CID 22138436) has the molecular formula C4H6ClNO3 and a molecular weight of 151.55 g/mol. Its IUPAC name is 1-hydroxypyrrolidine-2,5-dione;hydrochloride.

Molecular Properties

Compound Name1-hydroxypyrrolidine-2,5-dione;hydrochloride
PubChem CID22138436
Molecular FormulaC4H6ClNO3
Molecular Weight151.55 g/mol
Exact Mass151.00
IUPAC Name1-hydroxypyrrolidine-2,5-dione;hydrochloride
SMILESCl.O=C1CCC(=O)N1O
InChIInChI=1S/C4H5NO3.ClH/c6-3-1-2-4(7)5(3)8;/h8H,1-2H2;1H
InChIKeyGOODXEAJZGMZKG-UHFFFAOYSA-N
XLogP-0.05
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.55
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxypyrrolidine-2,5-dione;hydrochloride?
The IUPAC name of 1-hydroxypyrrolidine-2,5-dione;hydrochloride (CID 22138436) is 1-hydroxypyrrolidine-2,5-dione;hydrochloride.
What is the SMILES notation for 1-hydroxypyrrolidine-2,5-dione;hydrochloride?
The canonical SMILES for 1-hydroxypyrrolidine-2,5-dione;hydrochloride is Cl.O=C1CCC(=O)N1O.
What is the InChIKey of 1-hydroxypyrrolidine-2,5-dione;hydrochloride?
The InChIKey is GOODXEAJZGMZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO3.ClH/c6-3-1-2-4(7)5(3)8;/h8H,1-2H2;1H.
What are the key properties of 1-hydroxypyrrolidine-2,5-dione;hydrochloride?
1-hydroxypyrrolidine-2,5-dione;hydrochloride has a molecular weight of 151.55 g/mol, XLogP of -0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxypyrrolidine-2,5-dione;hydrochloride is sourced from PubChem (CID 22138436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).