2-methyl-8-pyrazin-2-yloxyquinoline

C14H11N3O — CID 2539875

IUPAC2-methyl-8-pyrazin-2-yloxyquinoline
SMILESCc1ccc2cccc(Oc3cnccn3)c2n1
InChIInChI=1S/C14H11N3O/c1-10-5-6-11-3-2-4-12(14(11)17-10)18-13-9-15-7-8-16-13/h2-9H,1H3
InChIKeyBTQKEIVIKRZLKH-UHFFFAOYSA-N
MW237.26 g/mol
LogP3.13
Rot. Bonds2

About 2-methyl-8-pyrazin-2-yloxyquinoline

2-methyl-8-pyrazin-2-yloxyquinoline (PubChem CID 2539875) has the molecular formula C14H11N3O and a molecular weight of 237.26 g/mol. Its IUPAC name is 2-methyl-8-pyrazin-2-yloxyquinoline.

Molecular Properties

Compound Name2-methyl-8-pyrazin-2-yloxyquinoline
PubChem CID2539875
Molecular FormulaC14H11N3O
Molecular Weight237.26 g/mol
Exact Mass237.09
IUPAC Name2-methyl-8-pyrazin-2-yloxyquinoline
SMILESCc1ccc2cccc(Oc3cnccn3)c2n1
InChIInChI=1S/C14H11N3O/c1-10-5-6-11-3-2-4-12(14(11)17-10)18-13-9-15-7-8-16-13/h2-9H,1H3
InChIKeyBTQKEIVIKRZLKH-UHFFFAOYSA-N
XLogP3.13
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-8-pyrazin-2-yloxyquinoline?
The IUPAC name of 2-methyl-8-pyrazin-2-yloxyquinoline (CID 2539875) is 2-methyl-8-pyrazin-2-yloxyquinoline.
What is the SMILES notation for 2-methyl-8-pyrazin-2-yloxyquinoline?
The canonical SMILES for 2-methyl-8-pyrazin-2-yloxyquinoline is Cc1ccc2cccc(Oc3cnccn3)c2n1.
What is the InChIKey of 2-methyl-8-pyrazin-2-yloxyquinoline?
The InChIKey is BTQKEIVIKRZLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O/c1-10-5-6-11-3-2-4-12(14(11)17-10)18-13-9-15-7-8-16-13/h2-9H,1H3.
What are the key properties of 2-methyl-8-pyrazin-2-yloxyquinoline?
2-methyl-8-pyrazin-2-yloxyquinoline has a molecular weight of 237.26 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8-pyrazin-2-yloxyquinoline is sourced from PubChem (CID 2539875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).