4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one

C10H9N3O3 — CID 103347853

IUPAC4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one
SMILESCOc1cccc(-c2nc(O)cc(=O)[nH]2)n1
InChIInChI=1S/C10H9N3O3/c1-16-9-4-2-3-6(11-9)10-12-7(14)5-8(15)13-10/h2-5H,1H3,(H2,12,13,14,15)
InChIKeyHEZQVUVAWZWZRE-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.55
Rot. Bonds2

About 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one

4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one (PubChem CID 103347853) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one
PubChem CID103347853
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC Name4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one
SMILESCOc1cccc(-c2nc(O)cc(=O)[nH]2)n1
InChIInChI=1S/C10H9N3O3/c1-16-9-4-2-3-6(11-9)10-12-7(14)5-8(15)13-10/h2-5H,1H3,(H2,12,13,14,15)
InChIKeyHEZQVUVAWZWZRE-UHFFFAOYSA-N
XLogP0.55
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one?
The IUPAC name of 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one (CID 103347853) is 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one?
The canonical SMILES for 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one is COc1cccc(-c2nc(O)cc(=O)[nH]2)n1.
What is the InChIKey of 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one?
The InChIKey is HEZQVUVAWZWZRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c1-16-9-4-2-3-6(11-9)10-12-7(14)5-8(15)13-10/h2-5H,1H3,(H2,12,13,14,15).
What are the key properties of 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one?
4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one has a molecular weight of 219.20 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 103347853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).