2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one

C16H14N2O2 — CID 62849976

IUPAC2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one
SMILESO=c1cccnn1CC(O)c1ccc2ccccc2c1
InChIInChI=1S/C16H14N2O2/c19-15(11-18-16(20)6-3-9-17-18)14-8-7-12-4-1-2-5-13(12)10-14/h1-10,15,19H,11H2
InChIKeyPZJHDXIIWKVXJA-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.13
Rot. Bonds3

About 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one

2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one (PubChem CID 62849976) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one.

Molecular Properties

Compound Name2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one
PubChem CID62849976
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one
SMILESO=c1cccnn1CC(O)c1ccc2ccccc2c1
InChIInChI=1S/C16H14N2O2/c19-15(11-18-16(20)6-3-9-17-18)14-8-7-12-4-1-2-5-13(12)10-14/h1-10,15,19H,11H2
InChIKeyPZJHDXIIWKVXJA-UHFFFAOYSA-N
XLogP2.13
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(3,4-dimethylphenyl)-2-hydroxyethyl]pyridazin-3-one
CID 55126638
3-(2-hydroxy-2-naphthalen-2-ylethyl)pyrimidin-4-one
CID 63769203
2-[2-(2-fluorophenyl)-2-hydroxyethyl]pyridazin-3-one
CID 107143258
1-(2-hydroxy-2-naphthalen-2-ylethyl)-4-methylpyridin-2-one
CID 62963596
1-ethyl-3-(2-hydroxy-2-naphthalen-2-ylethyl)imidazol-2-one
CID 80580603
2-[2-amino-2-(4-methoxyphenyl)ethyl]pyridazin-3-one
CID 62849597
3-(2-hydroxy-2-naphthalen-2-ylethyl)-1-methylimidazolidine-2,4-dione
CID 60969409
1-naphthalen-2-yl-2-pyridin-3-ylethanol
CID 62790666
1-(2-hydroxy-2-naphthalen-2-ylethyl)-4-methylpyrrolidin-2-one
CID 63100802
1-naphthalen-2-yl-2-phenylethanol
CID 2793947
ethane;1-naphthalen-2-ylpropan-1-ol
CID 143858826
methyl 3-hydroxy-3-naphthalen-2-ylpropanoate
CID 14361476

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one?
The IUPAC name of 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one (CID 62849976) is 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one.
What is the SMILES notation for 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one?
The canonical SMILES for 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one is O=c1cccnn1CC(O)c1ccc2ccccc2c1.
What is the InChIKey of 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one?
The InChIKey is PZJHDXIIWKVXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-15(11-18-16(20)6-3-9-17-18)14-8-7-12-4-1-2-5-13(12)10-14/h1-10,15,19H,11H2.
What are the key properties of 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one?
2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one has a molecular weight of 266.30 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-2-naphthalen-2-ylethyl)pyridazin-3-one is sourced from PubChem (CID 62849976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).