(6-quinolin-8-yloxypyrazin-2-yl)methanol

C14H11N3O2 — CID 66467992

IUPAC(6-quinolin-8-yloxypyrazin-2-yl)methanol
SMILESOCc1cncc(Oc2cccc3cccnc23)n1
InChIInChI=1S/C14H11N3O2/c18-9-11-7-15-8-13(17-11)19-12-5-1-3-10-4-2-6-16-14(10)12/h1-8,18H,9H2
InChIKeyKHJGXCLTJIFWOO-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.31
Rot. Bonds3

About (6-quinolin-8-yloxypyrazin-2-yl)methanol

(6-quinolin-8-yloxypyrazin-2-yl)methanol (PubChem CID 66467992) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is (6-quinolin-8-yloxypyrazin-2-yl)methanol.

Molecular Properties

Compound Name(6-quinolin-8-yloxypyrazin-2-yl)methanol
PubChem CID66467992
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC Name(6-quinolin-8-yloxypyrazin-2-yl)methanol
SMILESOCc1cncc(Oc2cccc3cccnc23)n1
InChIInChI=1S/C14H11N3O2/c18-9-11-7-15-8-13(17-11)19-12-5-1-3-10-4-2-6-16-14(10)12/h1-8,18H,9H2
InChIKeyKHJGXCLTJIFWOO-UHFFFAOYSA-N
XLogP2.31
TPSA68.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (6-quinolin-8-yloxypyrazin-2-yl)methanol?
The IUPAC name of (6-quinolin-8-yloxypyrazin-2-yl)methanol (CID 66467992) is (6-quinolin-8-yloxypyrazin-2-yl)methanol.
What is the SMILES notation for (6-quinolin-8-yloxypyrazin-2-yl)methanol?
The canonical SMILES for (6-quinolin-8-yloxypyrazin-2-yl)methanol is OCc1cncc(Oc2cccc3cccnc23)n1.
What is the InChIKey of (6-quinolin-8-yloxypyrazin-2-yl)methanol?
The InChIKey is KHJGXCLTJIFWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c18-9-11-7-15-8-13(17-11)19-12-5-1-3-10-4-2-6-16-14(10)12/h1-8,18H,9H2.
What are the key properties of (6-quinolin-8-yloxypyrazin-2-yl)methanol?
(6-quinolin-8-yloxypyrazin-2-yl)methanol has a molecular weight of 253.26 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-quinolin-8-yloxypyrazin-2-yl)methanol is sourced from PubChem (CID 66467992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).