6-amino-2-methoxy-3-methylpyrimidin-4-one

C6H9N3O2 — CID 817205

IUPAC6-amino-2-methoxy-3-methylpyrimidin-4-one
SMILESCOc1nc(N)cc(=O)n1C
InChIInChI=1S/C6H9N3O2/c1-9-5(10)3-4(7)8-6(9)11-2/h3H,7H2,1-2H3
InChIKeyWXTQNKJTTANZAH-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.63
Rot. Bonds1

About 6-amino-2-methoxy-3-methylpyrimidin-4-one

6-amino-2-methoxy-3-methylpyrimidin-4-one (PubChem CID 817205) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 6-amino-2-methoxy-3-methylpyrimidin-4-one.

Molecular Properties

Compound Name6-amino-2-methoxy-3-methylpyrimidin-4-one
PubChem CID817205
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name6-amino-2-methoxy-3-methylpyrimidin-4-one
SMILESCOc1nc(N)cc(=O)n1C
InChIInChI=1S/C6H9N3O2/c1-9-5(10)3-4(7)8-6(9)11-2/h3H,7H2,1-2H3
InChIKeyWXTQNKJTTANZAH-UHFFFAOYSA-N
XLogP-0.63
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methoxy-3-methylpyrimidin-4-one?
The IUPAC name of 6-amino-2-methoxy-3-methylpyrimidin-4-one (CID 817205) is 6-amino-2-methoxy-3-methylpyrimidin-4-one.
What is the SMILES notation for 6-amino-2-methoxy-3-methylpyrimidin-4-one?
The canonical SMILES for 6-amino-2-methoxy-3-methylpyrimidin-4-one is COc1nc(N)cc(=O)n1C.
What is the InChIKey of 6-amino-2-methoxy-3-methylpyrimidin-4-one?
The InChIKey is WXTQNKJTTANZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-9-5(10)3-4(7)8-6(9)11-2/h3H,7H2,1-2H3.
What are the key properties of 6-amino-2-methoxy-3-methylpyrimidin-4-one?
6-amino-2-methoxy-3-methylpyrimidin-4-one has a molecular weight of 155.16 g/mol, XLogP of -0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methoxy-3-methylpyrimidin-4-one is sourced from PubChem (CID 817205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).