2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one

C6H11NO3 — CID 173052176

IUPAC2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one
SMILESO=C1CCN(CCO)C1O
InChIInChI=1S/C6H11NO3/c8-4-3-7-2-1-5(9)6(7)10/h6,8,10H,1-4H2
InChIKeyXRDBKRITKOMXIO-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.43
Rot. Bonds2

About 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one

2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one (PubChem CID 173052176) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one.

Molecular Properties

Compound Name2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one
PubChem CID173052176
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one
SMILESO=C1CCN(CCO)C1O
InChIInChI=1S/C6H11NO3/c8-4-3-7-2-1-5(9)6(7)10/h6,8,10H,1-4H2
InChIKeyXRDBKRITKOMXIO-UHFFFAOYSA-N
XLogP-1.43
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(hydroxymethyl)-1-methylpyrrolidin-3-one
CID 142983641
3-ethyl-1-(2-hydroxyethyl)piperidin-4-one
CID 114508617
1-(2-hydroxyethyl)piperidin-4-one
CID 15006446
7-[(2S)-1-(4-hydroxybutyl)-3-oxopyrrolidin-2-yl]heptanoic acid
CID 59659393
1-ethenyl-2-(2-hydroxyethyl)pyrrolidin-3-one
CID 123620665
(3S)-3-amino-1-(2-hydroxyethyl)pyrrolidin-2-one;hydrochloride
CID 67416985
arsane;1-(2-hydroxyethyl)pyrrolidin-2-one
CID 174911308
2-(2-hydroxyethyl)-1,3,5,6,7,8a-hexahydro-[1,2,4]triazolo[4,3-a]pyridin-8-one
CID 67836233
2-(2,3-dimethylimidazolidin-1-yl)ethanol
CID 67521197
3,4-dihydroxy-1-(2-hydroxyethyl)pyrrolidin-2-one
CID 123921476
3-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one;hydrate
CID 175014118
1-decyl-2-methylpyrrolidin-3-one
CID 175583922

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one?
The IUPAC name of 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one (CID 173052176) is 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one.
What is the SMILES notation for 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one?
The canonical SMILES for 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one is O=C1CCN(CCO)C1O.
What is the InChIKey of 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one?
The InChIKey is XRDBKRITKOMXIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c8-4-3-7-2-1-5(9)6(7)10/h6,8,10H,1-4H2.
What are the key properties of 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one?
2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one has a molecular weight of 145.16 g/mol, XLogP of -1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-(2-hydroxyethyl)pyrrolidin-3-one is sourced from PubChem (CID 173052176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).