4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one

C14H15N3O4 — CID 69165376

IUPAC4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one
SMILESO=c1[nH]c(N2CC[C@@H](O)C2)ccc1-n1ccc(O)cc1=O
InChIInChI=1S/C14H15N3O4/c18-9-4-6-17(13(20)7-9)11-1-2-12(15-14(11)21)16-5-3-10(19)8-16/h1-2,4,6-7,10,18-19H,3,5,8H2,(H,15,21)/t10-/m1/s1
InChIKeyZJPXIXZIQXXMCF-SNVBAGLBSA-N
MW289.29 g/mol
LogP-0.20
Rot. Bonds2

About 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one

4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one (PubChem CID 69165376) has the molecular formula C14H15N3O4 and a molecular weight of 289.29 g/mol. Its IUPAC name is 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one
PubChem CID69165376
Molecular FormulaC14H15N3O4
Molecular Weight289.29 g/mol
Exact Mass289.11
IUPAC Name4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one
SMILESO=c1[nH]c(N2CC[C@@H](O)C2)ccc1-n1ccc(O)cc1=O
InChIInChI=1S/C14H15N3O4/c18-9-4-6-17(13(20)7-9)11-1-2-12(15-14(11)21)16-5-3-10(19)8-16/h1-2,4,6-7,10,18-19H,3,5,8H2,(H,15,21)/t10-/m1/s1
InChIKeyZJPXIXZIQXXMCF-SNVBAGLBSA-N
XLogP-0.20
TPSA98.56 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.29
LogP ≤ 5-0.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one?
The IUPAC name of 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one (CID 69165376) is 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one.
What is the SMILES notation for 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one?
The canonical SMILES for 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one is O=c1[nH]c(N2CC[C@@H](O)C2)ccc1-n1ccc(O)cc1=O.
What is the InChIKey of 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one?
The InChIKey is ZJPXIXZIQXXMCF-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H15N3O4/c18-9-4-6-17(13(20)7-9)11-1-2-12(15-14(11)21)16-5-3-10(19)8-16/h1-2,4,6-7,10,18-19H,3,5,8H2,(H,15,21)/t10-/m1/s1.
What are the key properties of 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one?
4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one has a molecular weight of 289.29 g/mol, XLogP of -0.20, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-[6-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]pyridin-2-one is sourced from PubChem (CID 69165376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).