4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one

C10H11N3O — CID 163274997

IUPAC4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one
SMILESCCc1ncnc2cc(=O)n(C)cc12
InChIInChI=1S/C10H11N3O/c1-3-8-7-5-13(2)10(14)4-9(7)12-6-11-8/h4-6H,3H2,1-2H3
InChIKeySRHLKPXPUHCQMG-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.89
Rot. Bonds1

About 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one

4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one (PubChem CID 163274997) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one
PubChem CID163274997
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one
SMILESCCc1ncnc2cc(=O)n(C)cc12
InChIInChI=1S/C10H11N3O/c1-3-8-7-5-13(2)10(14)4-9(7)12-6-11-8/h4-6H,3H2,1-2H3
InChIKeySRHLKPXPUHCQMG-UHFFFAOYSA-N
XLogP0.89
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one?
The IUPAC name of 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one (CID 163274997) is 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one.
What is the SMILES notation for 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one?
The canonical SMILES for 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one is CCc1ncnc2cc(=O)n(C)cc12.
What is the InChIKey of 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one?
The InChIKey is SRHLKPXPUHCQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-3-8-7-5-13(2)10(14)4-9(7)12-6-11-8/h4-6H,3H2,1-2H3.
What are the key properties of 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one?
4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one has a molecular weight of 189.22 g/mol, XLogP of 0.89, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-methylpyrido[4,3-d]pyrimidin-7-one is sourced from PubChem (CID 163274997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).