(4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol

C15H13N3O2 — CID 103045423

IUPAC(4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol
SMILESCc1nc(Oc2cccc3ncccc23)ncc1CO
InChIInChI=1S/C15H13N3O2/c1-10-11(9-19)8-17-15(18-10)20-14-6-2-5-13-12(14)4-3-7-16-13/h2-8,19H,9H2,1H3
InChIKeyIJQHELMXSCCEQV-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.62
Rot. Bonds3

About (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol

(4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol (PubChem CID 103045423) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol.

Molecular Properties

Compound Name(4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol
PubChem CID103045423
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name(4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol
SMILESCc1nc(Oc2cccc3ncccc23)ncc1CO
InChIInChI=1S/C15H13N3O2/c1-10-11(9-19)8-17-15(18-10)20-14-6-2-5-13-12(14)4-3-7-16-13/h2-8,19H,9H2,1H3
InChIKeyIJQHELMXSCCEQV-UHFFFAOYSA-N
XLogP2.62
TPSA68.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol?
The IUPAC name of (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol (CID 103045423) is (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol.
What is the SMILES notation for (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol?
The canonical SMILES for (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol is Cc1nc(Oc2cccc3ncccc23)ncc1CO.
What is the InChIKey of (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol?
The InChIKey is IJQHELMXSCCEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-10-11(9-19)8-17-15(18-10)20-14-6-2-5-13-12(14)4-3-7-16-13/h2-8,19H,9H2,1H3.
What are the key properties of (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol?
(4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol has a molecular weight of 267.29 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-quinolin-5-yloxypyrimidin-5-yl)methanol is sourced from PubChem (CID 103045423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).