4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one

C14H15N3O3 — CID 59704541

IUPAC4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one
SMILESO=c1cc(O)ccn1-c1ccc(N2CC[C@@H](O)C2)cn1
InChIInChI=1S/C14H15N3O3/c18-11-4-6-17(14(20)7-11)13-2-1-10(8-15-13)16-5-3-12(19)9-16/h1-2,4,6-8,12,18-19H,3,5,9H2/t12-/m1/s1
InChIKeyGEYDUMAVUYKHMO-GFCCVEGCSA-N
MW273.29 g/mol
LogP0.51
Rot. Bonds2

About 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one

4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one (PubChem CID 59704541) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one
PubChem CID59704541
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one
SMILESO=c1cc(O)ccn1-c1ccc(N2CC[C@@H](O)C2)cn1
InChIInChI=1S/C14H15N3O3/c18-11-4-6-17(14(20)7-11)13-2-1-10(8-15-13)16-5-3-12(19)9-16/h1-2,4,6-8,12,18-19H,3,5,9H2/t12-/m1/s1
InChIKeyGEYDUMAVUYKHMO-GFCCVEGCSA-N
XLogP0.51
TPSA78.59 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one?
The IUPAC name of 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one (CID 59704541) is 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one.
What is the SMILES notation for 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one?
The canonical SMILES for 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one is O=c1cc(O)ccn1-c1ccc(N2CC[C@@H](O)C2)cn1.
What is the InChIKey of 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one?
The InChIKey is GEYDUMAVUYKHMO-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-11-4-6-17(14(20)7-11)13-2-1-10(8-15-13)16-5-3-12(19)9-16/h1-2,4,6-8,12,18-19H,3,5,9H2/t12-/m1/s1.
What are the key properties of 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one?
4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one has a molecular weight of 273.29 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-pyridinyl]pyridin-2-one is sourced from PubChem (CID 59704541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).