5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one

C9H8N4O2 — CID 19152683

IUPAC5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one
SMILESNc1c(Oc2cccnc2)nc[nH]c1=O
InChIInChI=1S/C9H8N4O2/c10-7-8(14)12-5-13-9(7)15-6-2-1-3-11-4-6/h1-5H,10H2,(H,12,13,14)
InChIKeyLHGKFYWAYHLFLR-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.54
Rot. Bonds2

About 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one

5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one (PubChem CID 19152683) has the molecular formula C9H8N4O2 and a molecular weight of 204.19 g/mol. Its IUPAC name is 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one
PubChem CID19152683
Molecular FormulaC9H8N4O2
Molecular Weight204.19 g/mol
Exact Mass204.06
IUPAC Name5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one
SMILESNc1c(Oc2cccnc2)nc[nH]c1=O
InChIInChI=1S/C9H8N4O2/c10-7-8(14)12-5-13-9(7)15-6-2-1-3-11-4-6/h1-5H,10H2,(H,12,13,14)
InChIKeyLHGKFYWAYHLFLR-UHFFFAOYSA-N
XLogP0.54
TPSA93.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one (CID 19152683) is 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one is Nc1c(Oc2cccnc2)nc[nH]c1=O.
What is the InChIKey of 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one?
The InChIKey is LHGKFYWAYHLFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4O2/c10-7-8(14)12-5-13-9(7)15-6-2-1-3-11-4-6/h1-5H,10H2,(H,12,13,14).
What are the key properties of 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one?
5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one has a molecular weight of 204.19 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-pyridin-3-yloxy-1H-pyrimidin-6-one is sourced from PubChem (CID 19152683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).