2-(2-oxopyrrolidin-1-yl)ethylazanium

C6H13N2O+ — CID 7446746

IUPAC2-(2-oxopyrrolidin-1-yl)ethylazanium
SMILES[NH3+]CCN1CCCC1=O
InChIInChI=1S/C6H12N2O/c7-3-5-8-4-1-2-6(8)9/h1-5,7H2/p+1
InChIKeyHHEKNWQXFVOUNJ-UHFFFAOYSA-O
MW129.18 g/mol
LogP-1.15
Rot. Bonds2

About 2-(2-oxopyrrolidin-1-yl)ethylazanium

2-(2-oxopyrrolidin-1-yl)ethylazanium (PubChem CID 7446746) has the molecular formula C6H13N2O+ and a molecular weight of 129.18 g/mol. Its IUPAC name is 2-(2-oxopyrrolidin-1-yl)ethylazanium.

Molecular Properties

Compound Name2-(2-oxopyrrolidin-1-yl)ethylazanium
PubChem CID7446746
Molecular FormulaC6H13N2O+
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name2-(2-oxopyrrolidin-1-yl)ethylazanium
SMILES[NH3+]CCN1CCCC1=O
InChIInChI=1S/C6H12N2O/c7-3-5-8-4-1-2-6(8)9/h1-5,7H2/p+1
InChIKeyHHEKNWQXFVOUNJ-UHFFFAOYSA-O
XLogP-1.15
TPSA47.95 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 5-1.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-silylethyl)pyrrolidin-2-one
CID 154480854
arsane;1-(2-hydroxyethyl)pyrrolidin-2-one
CID 174911308
azane;1-(2-bromoethyl)pyrrolidin-2-one
CID 174693933
1-(4,4-dimethylpentyl)pyrrolidin-2-one
CID 23542009
1-(4,4-dimethylhexyl)pyrrolidin-2-one
CID 138551273
N-amino-N-[2-(2-oxopyrrolidin-1-yl)ethyl]formamide
CID 88601198
sodium 2-oxo-1-(2-sulfonatosulfanylethyl)pyrrolidine
CID 23698158
1-(22-hydroxydocosyl)pyrrolidin-2-one
CID 151557638
1-dodecylpyrrolidin-2-one
CID 70222371
1-hexylpyrrolidin-2-one
CID 158904818
1-[2-[3-[2-(2-oxopyrrolidin-1-yl)ethylamino]propylamino]ethyl]pyrrolidin-2-one
CID 19837416
1-(4-aminobutyl)pyrrolidin-2-one;hydrochloride
CID 56604167

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxopyrrolidin-1-yl)ethylazanium?
The IUPAC name of 2-(2-oxopyrrolidin-1-yl)ethylazanium (CID 7446746) is 2-(2-oxopyrrolidin-1-yl)ethylazanium.
What is the SMILES notation for 2-(2-oxopyrrolidin-1-yl)ethylazanium?
The canonical SMILES for 2-(2-oxopyrrolidin-1-yl)ethylazanium is [NH3+]CCN1CCCC1=O.
What is the InChIKey of 2-(2-oxopyrrolidin-1-yl)ethylazanium?
The InChIKey is HHEKNWQXFVOUNJ-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H12N2O/c7-3-5-8-4-1-2-6(8)9/h1-5,7H2/p+1.
What are the key properties of 2-(2-oxopyrrolidin-1-yl)ethylazanium?
2-(2-oxopyrrolidin-1-yl)ethylazanium has a molecular weight of 129.18 g/mol, XLogP of -1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxopyrrolidin-1-yl)ethylazanium is sourced from PubChem (CID 7446746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).