2-methyl-6-naphthalen-2-ylpyridazin-3-one

C15H12N2O — CID 7664086

IUPAC2-methyl-6-naphthalen-2-ylpyridazin-3-one
SMILESCn1nc(-c2ccc3ccccc3c2)ccc1=O
InChIInChI=1S/C15H12N2O/c1-17-15(18)9-8-14(16-17)13-7-6-11-4-2-3-5-12(11)10-13/h2-10H,1H3
InChIKeyNYONWMFXBQBQGS-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.60
Rot. Bonds1

About 2-methyl-6-naphthalen-2-ylpyridazin-3-one

2-methyl-6-naphthalen-2-ylpyridazin-3-one (PubChem CID 7664086) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-methyl-6-naphthalen-2-ylpyridazin-3-one.

Molecular Properties

Compound Name2-methyl-6-naphthalen-2-ylpyridazin-3-one
PubChem CID7664086
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name2-methyl-6-naphthalen-2-ylpyridazin-3-one
SMILESCn1nc(-c2ccc3ccccc3c2)ccc1=O
InChIInChI=1S/C15H12N2O/c1-17-15(18)9-8-14(16-17)13-7-6-11-4-2-3-5-12(11)10-13/h2-10H,1H3
InChIKeyNYONWMFXBQBQGS-UHFFFAOYSA-N
XLogP2.60
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-naphthalen-2-ylpyridazin-3-one?
The IUPAC name of 2-methyl-6-naphthalen-2-ylpyridazin-3-one (CID 7664086) is 2-methyl-6-naphthalen-2-ylpyridazin-3-one.
What is the SMILES notation for 2-methyl-6-naphthalen-2-ylpyridazin-3-one?
The canonical SMILES for 2-methyl-6-naphthalen-2-ylpyridazin-3-one is Cn1nc(-c2ccc3ccccc3c2)ccc1=O.
What is the InChIKey of 2-methyl-6-naphthalen-2-ylpyridazin-3-one?
The InChIKey is NYONWMFXBQBQGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-17-15(18)9-8-14(16-17)13-7-6-11-4-2-3-5-12(11)10-13/h2-10H,1H3.
What are the key properties of 2-methyl-6-naphthalen-2-ylpyridazin-3-one?
2-methyl-6-naphthalen-2-ylpyridazin-3-one has a molecular weight of 236.27 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-naphthalen-2-ylpyridazin-3-one is sourced from PubChem (CID 7664086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).