4-ethyl-6-methoxypyrido[3,4-d]pyrimidine

C10H11N3O — CID 167049186

IUPAC4-ethyl-6-methoxypyrido[3,4-d]pyrimidine
SMILESCCc1ncnc2cnc(OC)cc12
InChIInChI=1S/C10H11N3O/c1-3-8-7-4-10(14-2)11-5-9(7)13-6-12-8/h4-6H,3H2,1-2H3
InChIKeyWZZPCYGILIUXLB-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.60
Rot. Bonds2

About 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine

4-ethyl-6-methoxypyrido[3,4-d]pyrimidine (PubChem CID 167049186) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine.

Molecular Properties

Compound Name4-ethyl-6-methoxypyrido[3,4-d]pyrimidine
PubChem CID167049186
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name4-ethyl-6-methoxypyrido[3,4-d]pyrimidine
SMILESCCc1ncnc2cnc(OC)cc12
InChIInChI=1S/C10H11N3O/c1-3-8-7-4-10(14-2)11-5-9(7)13-6-12-8/h4-6H,3H2,1-2H3
InChIKeyWZZPCYGILIUXLB-UHFFFAOYSA-N
XLogP1.60
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine?
The IUPAC name of 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine (CID 167049186) is 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine.
What is the SMILES notation for 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine?
The canonical SMILES for 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine is CCc1ncnc2cnc(OC)cc12.
What is the InChIKey of 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine?
The InChIKey is WZZPCYGILIUXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-3-8-7-4-10(14-2)11-5-9(7)13-6-12-8/h4-6H,3H2,1-2H3.
What are the key properties of 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine?
4-ethyl-6-methoxypyrido[3,4-d]pyrimidine has a molecular weight of 189.22 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-methoxypyrido[3,4-d]pyrimidine is sourced from PubChem (CID 167049186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).