4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one

C10H12N2O3 — CID 168703715

IUPAC4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
SMILESO=C1CC(O)CN1c1ncccc1CO
InChIInChI=1S/C10H12N2O3/c13-6-7-2-1-3-11-10(7)12-5-8(14)4-9(12)15/h1-3,8,13-14H,4-6H2
InChIKeyDCIQDFBTCZIEME-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.33
Rot. Bonds2

About 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one

4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one (PubChem CID 168703715) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
PubChem CID168703715
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
SMILESO=C1CC(O)CN1c1ncccc1CO
InChIInChI=1S/C10H12N2O3/c13-6-7-2-1-3-11-10(7)12-5-8(14)4-9(12)15/h1-3,8,13-14H,4-6H2
InChIKeyDCIQDFBTCZIEME-UHFFFAOYSA-N
XLogP-0.33
TPSA73.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-ethyl-2-pyridinyl)-4-sulfanylpyrrolidin-2-one
CID 168708315
1-(2-bromo-3-pyridinyl)-4-hydroxypyrrolidin-2-one
CID 168703965
1-(2-fluoro-3-pyridinyl)-4-hydroxypyrrolidin-2-one
CID 168703969
4-hydroxy-1-[4-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
CID 168704116
methyl 1-(3-ethyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxylate
CID 168693214
4-hydroxy-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
CID 168702268
1-(3-ethyl-2-pyridinyl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711290
4-hydroxy-1-(2-methoxy-3-pyridinyl)pyrrolidin-2-one
CID 168702386
1-(3-bromo-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663841
3-(4-hydroxy-2-oxopyrrolidin-1-yl)pyridine-2-carbonitrile
CID 168703966
1-[2-(aminomethyl)phenyl]-4-hydroxypyrrolidin-2-one
CID 168703041
[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol
CID 115561195

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one?
The IUPAC name of 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one (CID 168703715) is 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one.
What is the SMILES notation for 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one?
The canonical SMILES for 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one is O=C1CC(O)CN1c1ncccc1CO.
What is the InChIKey of 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one?
The InChIKey is DCIQDFBTCZIEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-6-7-2-1-3-11-10(7)12-5-8(14)4-9(12)15/h1-3,8,13-14H,4-6H2.
What are the key properties of 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one?
4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one has a molecular weight of 208.22 g/mol, XLogP of -0.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-[3-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one is sourced from PubChem (CID 168703715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).