5-aminopyrrolidin-2-one;hydrochloride

C4H9ClN2O — CID 67838433

IUPAC5-aminopyrrolidin-2-one;hydrochloride
SMILESCl.NC1CCC(=O)N1
InChIInChI=1S/C4H8N2O.ClH/c5-3-1-2-4(7)6-3;/h3H,1-2,5H2,(H,6,7);1H
InChIKeyREACYXHSICDSRR-UHFFFAOYSA-N
MW136.58 g/mol
LogP-0.40
Rot. Bonds

About 5-aminopyrrolidin-2-one;hydrochloride

5-aminopyrrolidin-2-one;hydrochloride (PubChem CID 67838433) has the molecular formula C4H9ClN2O and a molecular weight of 136.58 g/mol. Its IUPAC name is 5-aminopyrrolidin-2-one;hydrochloride.

Molecular Properties

Compound Name5-aminopyrrolidin-2-one;hydrochloride
PubChem CID67838433
Molecular FormulaC4H9ClN2O
Molecular Weight136.58 g/mol
Exact Mass136.04
IUPAC Name5-aminopyrrolidin-2-one;hydrochloride
SMILESCl.NC1CCC(=O)N1
InChIInChI=1S/C4H8N2O.ClH/c5-3-1-2-4(7)6-3;/h3H,1-2,5H2,(H,6,7);1H
InChIKeyREACYXHSICDSRR-UHFFFAOYSA-N
XLogP-0.40
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.58
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-aminopyrrolidin-2-one;hydrochloride?
The IUPAC name of 5-aminopyrrolidin-2-one;hydrochloride (CID 67838433) is 5-aminopyrrolidin-2-one;hydrochloride.
What is the SMILES notation for 5-aminopyrrolidin-2-one;hydrochloride?
The canonical SMILES for 5-aminopyrrolidin-2-one;hydrochloride is Cl.NC1CCC(=O)N1.
What is the InChIKey of 5-aminopyrrolidin-2-one;hydrochloride?
The InChIKey is REACYXHSICDSRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O.ClH/c5-3-1-2-4(7)6-3;/h3H,1-2,5H2,(H,6,7);1H.
What are the key properties of 5-aminopyrrolidin-2-one;hydrochloride?
5-aminopyrrolidin-2-one;hydrochloride has a molecular weight of 136.58 g/mol, XLogP of -0.40, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-aminopyrrolidin-2-one;hydrochloride is sourced from PubChem (CID 67838433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).