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

C8H9N5O2 — CID 130017594

IUPAC2-amino-6-methoxy-3-methylpteridin-4-one
SMILESCOc1cnc2nc(N)n(C)c(=O)c2n1
InChIInChI=1S/C8H9N5O2/c1-13-7(14)5-6(12-8(13)9)10-3-4(11-5)15-2/h3H,1-2H3,(H2,9,10,12)
InChIKeyXQZGFKWSWJYPDN-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.69
Rot. Bonds1

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

2-amino-6-methoxy-3-methylpteridin-4-one (PubChem CID 130017594) has the molecular formula C8H9N5O2 and a molecular weight of 207.19 g/mol. Its IUPAC name is 2-amino-6-methoxy-3-methylpteridin-4-one.

Molecular Properties

Compound Name2-amino-6-methoxy-3-methylpteridin-4-one
PubChem CID130017594
Molecular FormulaC8H9N5O2
Molecular Weight207.19 g/mol
Exact Mass207.08
IUPAC Name2-amino-6-methoxy-3-methylpteridin-4-one
SMILESCOc1cnc2nc(N)n(C)c(=O)c2n1
InChIInChI=1S/C8H9N5O2/c1-13-7(14)5-6(12-8(13)9)10-3-4(11-5)15-2/h3H,1-2H3,(H2,9,10,12)
InChIKeyXQZGFKWSWJYPDN-UHFFFAOYSA-N
XLogP-0.69
TPSA95.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Lcb-2183
CID 135418284
Dimethylpterin
CID 135443570
2-amino-N-methyl-4-oxo-3H-pteridine-7-carboxamide
CID 136025899
3-Methyl-2-(methylamino)pteridin-4-one
CID 127048051
2-acetamido-7-methylpteridin-4(3H)-one
CID 135401454
2-Methoxy-3-methyl-4(3H)-pteridinone
CID 379344
2-Amino-6-(ethoxymethyl)pteridin-4(1H)-one
CID 135674618
7-Methoxy-1,3-dimethylpteridine-2,4-dione
CID 822210
2-(2-Amino-4-oxo-pteridin-3-yl)ethoxymethylphosphonic acid
CID 472218
Pteridine, 2-amino-4-hydroxy-6-methoxy-
CID 136302252
N-(3-Methyl-4-oxo-3,4-dihydropteridin-2-yl)glycine
CID 71406915
N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
CID 53185604

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methoxy-3-methylpteridin-4-one?
The IUPAC name of 2-amino-6-methoxy-3-methylpteridin-4-one (CID 130017594) is 2-amino-6-methoxy-3-methylpteridin-4-one.
What is the SMILES notation for 2-amino-6-methoxy-3-methylpteridin-4-one?
The canonical SMILES for 2-amino-6-methoxy-3-methylpteridin-4-one is COc1cnc2nc(N)n(C)c(=O)c2n1.
What is the InChIKey of 2-amino-6-methoxy-3-methylpteridin-4-one?
The InChIKey is XQZGFKWSWJYPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O2/c1-13-7(14)5-6(12-8(13)9)10-3-4(11-5)15-2/h3H,1-2H3,(H2,9,10,12).
What are the key properties of 2-amino-6-methoxy-3-methylpteridin-4-one?
2-amino-6-methoxy-3-methylpteridin-4-one has a molecular weight of 207.19 g/mol, XLogP of -0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methoxy-3-methylpteridin-4-one is sourced from PubChem (CID 130017594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).