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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Related Compounds

2(1H)-Pyridinone, 5-ethyl-3-(((3-methoxy-2-pyridinyl)methyl)amino)-6-methyl-
CID 454366
2(1H)-Pyridinone, 5-ethyl-3-(((3-methoxy-4-pyridinyl)methyl)amino)-6-methyl-
CID 454364
3-((4,5-Dihydro-1H-imidazol-2-yl)methoxy)pyridine
CID 2796040
Carbamic acid, dimethyl-, (2-((dimethylamino)methyl)-3-pyridyl) ester, hydrochloride
CID 50803
3-[1-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-2-methylpyridine
CID 44372019
5-hydroxy-N-[2-(3-methoxy-4-pyridinyl)ethyl]-6-oxo-2-phenyl-1H-pyrimidine-4-carboxamide
CID 172439496
Pyridin-3-yl isopropylcarbamate
CID 66557840
2-methyl-6-oxo-N-[(2S)-2-pyridin-3-yloxypropyl]-1H-pyrimidine-5-carboxamide
CID 97138963
3-(5-methoxypyridin-2-yl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
CID 59939116
2-[(5-Fluoro-3-pyridinyl)oxymethyl]-3,6-dimethylpyrimidin-4-one
CID 117972885
5-fluoro-6-hydroxy-2-(5-methoxypyridin-2-yl)pyrimidine-4(3H)-one
CID 122505538
7-fluoro-4-methanimidoyl-1-[(2-methanimidoyl-3-pyridinyl)oxy]-2H-isoquinolin-3-one
CID 136137718

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).