2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol

C19H15N3O2 — CID 688644

IUPAC2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol
SMILESCN(c1ccc2cccc(O)c2n1)c1ccc2cccc(O)c2n1
InChIInChI=1S/C19H15N3O2/c1-22(16-10-8-12-4-2-6-14(23)18(12)20-16)17-11-9-13-5-3-7-15(24)19(13)21-17/h2-11,23-24H,1H3
InChIKeyMOWSBSPBYZOYAQ-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.96
Rot. Bonds2

About 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol

2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol (PubChem CID 688644) has the molecular formula C19H15N3O2 and a molecular weight of 317.35 g/mol. Its IUPAC name is 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol.

Molecular Properties

Compound Name2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol
PubChem CID688644
Molecular FormulaC19H15N3O2
Molecular Weight317.35 g/mol
Exact Mass317.12
IUPAC Name2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol
SMILESCN(c1ccc2cccc(O)c2n1)c1ccc2cccc(O)c2n1
InChIInChI=1S/C19H15N3O2/c1-22(16-10-8-12-4-2-6-14(23)18(12)20-16)17-11-9-13-5-3-7-15(24)19(13)21-17/h2-11,23-24H,1H3
InChIKeyMOWSBSPBYZOYAQ-UHFFFAOYSA-N
XLogP3.96
TPSA69.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol?
The IUPAC name of 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol (CID 688644) is 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol.
What is the SMILES notation for 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol?
The canonical SMILES for 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol is CN(c1ccc2cccc(O)c2n1)c1ccc2cccc(O)c2n1.
What is the InChIKey of 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol?
The InChIKey is MOWSBSPBYZOYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2/c1-22(16-10-8-12-4-2-6-14(23)18(12)20-16)17-11-9-13-5-3-7-15(24)19(13)21-17/h2-11,23-24H,1H3.
What are the key properties of 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol?
2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol has a molecular weight of 317.35 g/mol, XLogP of 3.96, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8-hydroxyquinolin-2-yl)-methylamino]quinolin-8-ol is sourced from PubChem (CID 688644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).