3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol

C15H12N2O2 — CID 61313118

IUPAC3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol
SMILESCc1ccc(Oc2cc3ccccc3cc2O)nn1
InChIInChI=1S/C15H12N2O2/c1-10-6-7-15(17-16-10)19-14-9-12-5-3-2-4-11(12)8-13(14)18/h2-9,18H,1H3
InChIKeyQDTUWOLMRNZLME-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.44
Rot. Bonds2

About 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol

3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol (PubChem CID 61313118) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol.

Molecular Properties

Compound Name3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol
PubChem CID61313118
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol
SMILESCc1ccc(Oc2cc3ccccc3cc2O)nn1
InChIInChI=1S/C15H12N2O2/c1-10-6-7-15(17-16-10)19-14-9-12-5-3-2-4-11(12)8-13(14)18/h2-9,18H,1H3
InChIKeyQDTUWOLMRNZLME-UHFFFAOYSA-N
XLogP3.44
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol?
The IUPAC name of 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol (CID 61313118) is 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol.
What is the SMILES notation for 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol?
The canonical SMILES for 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol is Cc1ccc(Oc2cc3ccccc3cc2O)nn1.
What is the InChIKey of 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol?
The InChIKey is QDTUWOLMRNZLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10-6-7-15(17-16-10)19-14-9-12-5-3-2-4-11(12)8-13(14)18/h2-9,18H,1H3.
What are the key properties of 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol?
3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol has a molecular weight of 252.27 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methylpyridazin-3-yl)oxynaphthalen-2-ol is sourced from PubChem (CID 61313118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).