4-amino-2-methoxypyrimidin-5-ol

C5H7N3O2 — CID 131843778

IUPAC4-amino-2-methoxypyrimidin-5-ol
SMILESCOc1ncc(O)c(N)n1
InChIInChI=1S/C5H7N3O2/c1-10-5-7-2-3(9)4(6)8-5/h2,9H,1H3,(H2,6,7,8)
InChIKeyJZACERJPBFQHGA-UHFFFAOYSA-N
MW141.13 g/mol
LogP-0.23
Rot. Bonds1

About 4-amino-2-methoxypyrimidin-5-ol

4-amino-2-methoxypyrimidin-5-ol (PubChem CID 131843778) has the molecular formula C5H7N3O2 and a molecular weight of 141.13 g/mol. Its IUPAC name is 4-amino-2-methoxypyrimidin-5-ol.

Molecular Properties

Compound Name4-amino-2-methoxypyrimidin-5-ol
PubChem CID131843778
Molecular FormulaC5H7N3O2
Molecular Weight141.13 g/mol
Exact Mass141.05
IUPAC Name4-amino-2-methoxypyrimidin-5-ol
SMILESCOc1ncc(O)c(N)n1
InChIInChI=1S/C5H7N3O2/c1-10-5-7-2-3(9)4(6)8-5/h2,9H,1H3,(H2,6,7,8)
InChIKeyJZACERJPBFQHGA-UHFFFAOYSA-N
XLogP-0.23
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-methoxypyrimidin-5-ol?
The IUPAC name of 4-amino-2-methoxypyrimidin-5-ol (CID 131843778) is 4-amino-2-methoxypyrimidin-5-ol.
What is the SMILES notation for 4-amino-2-methoxypyrimidin-5-ol?
The canonical SMILES for 4-amino-2-methoxypyrimidin-5-ol is COc1ncc(O)c(N)n1.
What is the InChIKey of 4-amino-2-methoxypyrimidin-5-ol?
The InChIKey is JZACERJPBFQHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O2/c1-10-5-7-2-3(9)4(6)8-5/h2,9H,1H3,(H2,6,7,8).
What are the key properties of 4-amino-2-methoxypyrimidin-5-ol?
4-amino-2-methoxypyrimidin-5-ol has a molecular weight of 141.13 g/mol, XLogP of -0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-methoxypyrimidin-5-ol is sourced from PubChem (CID 131843778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).