2-cyclopropyl-6-methylpyridazin-3-one

C8H10N2O — CID 126857284

IUPAC2-cyclopropyl-6-methylpyridazin-3-one
SMILESCc1ccc(=O)n(C2CC2)n1
InChIInChI=1S/C8H10N2O/c1-6-2-5-8(11)10(9-6)7-3-4-7/h2,5,7H,3-4H2,1H3
InChIKeyITGIERRNIBTYNW-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.89
Rot. Bonds1

About 2-cyclopropyl-6-methylpyridazin-3-one

2-cyclopropyl-6-methylpyridazin-3-one (PubChem CID 126857284) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 2-cyclopropyl-6-methylpyridazin-3-one.

Molecular Properties

Compound Name2-cyclopropyl-6-methylpyridazin-3-one
PubChem CID126857284
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name2-cyclopropyl-6-methylpyridazin-3-one
SMILESCc1ccc(=O)n(C2CC2)n1
InChIInChI=1S/C8H10N2O/c1-6-2-5-8(11)10(9-6)7-3-4-7/h2,5,7H,3-4H2,1H3
InChIKeyITGIERRNIBTYNW-UHFFFAOYSA-N
XLogP0.89
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-methylpyridazin-3-one?
The IUPAC name of 2-cyclopropyl-6-methylpyridazin-3-one (CID 126857284) is 2-cyclopropyl-6-methylpyridazin-3-one.
What is the SMILES notation for 2-cyclopropyl-6-methylpyridazin-3-one?
The canonical SMILES for 2-cyclopropyl-6-methylpyridazin-3-one is Cc1ccc(=O)n(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-6-methylpyridazin-3-one?
The InChIKey is ITGIERRNIBTYNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-6-2-5-8(11)10(9-6)7-3-4-7/h2,5,7H,3-4H2,1H3.
What are the key properties of 2-cyclopropyl-6-methylpyridazin-3-one?
2-cyclopropyl-6-methylpyridazin-3-one has a molecular weight of 150.18 g/mol, XLogP of 0.89, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-methylpyridazin-3-one is sourced from PubChem (CID 126857284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).