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

C5H11ClN2O — CID 67280315

IUPAC3-amino-1-methylpyrrolidin-2-one;hydrochloride
SMILESCN1CCC(N)C1=O.Cl
InChIInChI=1S/C5H10N2O.ClH/c1-7-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3;1H
InChIKeyQRQPGSHDPDMQIE-UHFFFAOYSA-N
MW150.61 g/mol
LogP-0.40
Rot. Bonds

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

3-amino-1-methylpyrrolidin-2-one;hydrochloride (PubChem CID 67280315) has the molecular formula C5H11ClN2O and a molecular weight of 150.61 g/mol. Its IUPAC name is 3-amino-1-methylpyrrolidin-2-one;hydrochloride.

Molecular Properties

Compound Name3-amino-1-methylpyrrolidin-2-one;hydrochloride
PubChem CID67280315
Molecular FormulaC5H11ClN2O
Molecular Weight150.61 g/mol
Exact Mass150.06
IUPAC Name3-amino-1-methylpyrrolidin-2-one;hydrochloride
SMILESCN1CCC(N)C1=O.Cl
InChIInChI=1S/C5H10N2O.ClH/c1-7-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3;1H
InChIKeyQRQPGSHDPDMQIE-UHFFFAOYSA-N
XLogP-0.40
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 ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-methylpyrrolidin-2-one;hydrochloride?
The IUPAC name of 3-amino-1-methylpyrrolidin-2-one;hydrochloride (CID 67280315) is 3-amino-1-methylpyrrolidin-2-one;hydrochloride.
What is the SMILES notation for 3-amino-1-methylpyrrolidin-2-one;hydrochloride?
The canonical SMILES for 3-amino-1-methylpyrrolidin-2-one;hydrochloride is CN1CCC(N)C1=O.Cl.
What is the InChIKey of 3-amino-1-methylpyrrolidin-2-one;hydrochloride?
The InChIKey is QRQPGSHDPDMQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.ClH/c1-7-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3;1H.
What are the key properties of 3-amino-1-methylpyrrolidin-2-one;hydrochloride?
3-amino-1-methylpyrrolidin-2-one;hydrochloride has a molecular weight of 150.61 g/mol, XLogP of -0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-methylpyrrolidin-2-one;hydrochloride is sourced from PubChem (CID 67280315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).