1-amino-3-methylpyrrolidin-2-one;hydrochloride

C5H11ClN2O — CID 69367224

IUPAC1-amino-3-methylpyrrolidin-2-one;hydrochloride
SMILESCC1CCN(N)C1=O.Cl
InChIInChI=1S/C5H10N2O.ClH/c1-4-2-3-7(6)5(4)8;/h4H,2-3,6H2,1H3;1H
InChIKeyRFNMAXDNMSXTNQ-UHFFFAOYSA-N
MW150.61 g/mol
LogP0.15
Rot. Bonds

About 1-amino-3-methylpyrrolidin-2-one;hydrochloride

1-amino-3-methylpyrrolidin-2-one;hydrochloride (PubChem CID 69367224) has the molecular formula C5H11ClN2O and a molecular weight of 150.61 g/mol. Its IUPAC name is 1-amino-3-methylpyrrolidin-2-one;hydrochloride.

Molecular Properties

Compound Name1-amino-3-methylpyrrolidin-2-one;hydrochloride
PubChem CID69367224
Molecular FormulaC5H11ClN2O
Molecular Weight150.61 g/mol
Exact Mass150.06
IUPAC Name1-amino-3-methylpyrrolidin-2-one;hydrochloride
SMILESCC1CCN(N)C1=O.Cl
InChIInChI=1S/C5H10N2O.ClH/c1-4-2-3-7(6)5(4)8;/h4H,2-3,6H2,1H3;1H
InChIKeyRFNMAXDNMSXTNQ-UHFFFAOYSA-N
XLogP0.15
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.61
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-methylpyrrolidin-2-one;hydrochloride?
The IUPAC name of 1-amino-3-methylpyrrolidin-2-one;hydrochloride (CID 69367224) is 1-amino-3-methylpyrrolidin-2-one;hydrochloride.
What is the SMILES notation for 1-amino-3-methylpyrrolidin-2-one;hydrochloride?
The canonical SMILES for 1-amino-3-methylpyrrolidin-2-one;hydrochloride is CC1CCN(N)C1=O.Cl.
What is the InChIKey of 1-amino-3-methylpyrrolidin-2-one;hydrochloride?
The InChIKey is RFNMAXDNMSXTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.ClH/c1-4-2-3-7(6)5(4)8;/h4H,2-3,6H2,1H3;1H.
What are the key properties of 1-amino-3-methylpyrrolidin-2-one;hydrochloride?
1-amino-3-methylpyrrolidin-2-one;hydrochloride has a molecular weight of 150.61 g/mol, XLogP of 0.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-methylpyrrolidin-2-one;hydrochloride is sourced from PubChem (CID 69367224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).