4-(1-methylcyclopropyl)-1H-pyridazin-6-one

C8H10N2O — CID 170429115

IUPAC4-(1-methylcyclopropyl)-1H-pyridazin-6-one
SMILESCC1(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C8H10N2O/c1-8(2-3-8)6-4-7(11)10-9-5-6/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyOMFVICUTWHJDTK-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.82
Rot. Bonds1

About 4-(1-methylcyclopropyl)-1H-pyridazin-6-one

4-(1-methylcyclopropyl)-1H-pyridazin-6-one (PubChem CID 170429115) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 4-(1-methylcyclopropyl)-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-(1-methylcyclopropyl)-1H-pyridazin-6-one
PubChem CID170429115
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name4-(1-methylcyclopropyl)-1H-pyridazin-6-one
SMILESCC1(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C8H10N2O/c1-8(2-3-8)6-4-7(11)10-9-5-6/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyOMFVICUTWHJDTK-UHFFFAOYSA-N
XLogP0.82
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylcyclopropyl)-1H-pyridazin-6-one?
The IUPAC name of 4-(1-methylcyclopropyl)-1H-pyridazin-6-one (CID 170429115) is 4-(1-methylcyclopropyl)-1H-pyridazin-6-one.
What is the SMILES notation for 4-(1-methylcyclopropyl)-1H-pyridazin-6-one?
The canonical SMILES for 4-(1-methylcyclopropyl)-1H-pyridazin-6-one is CC1(c2cn[nH]c(=O)c2)CC1.
What is the InChIKey of 4-(1-methylcyclopropyl)-1H-pyridazin-6-one?
The InChIKey is OMFVICUTWHJDTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-8(2-3-8)6-4-7(11)10-9-5-6/h4-5H,2-3H2,1H3,(H,10,11).
What are the key properties of 4-(1-methylcyclopropyl)-1H-pyridazin-6-one?
4-(1-methylcyclopropyl)-1H-pyridazin-6-one has a molecular weight of 150.18 g/mol, XLogP of 0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylcyclopropyl)-1H-pyridazin-6-one is sourced from PubChem (CID 170429115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).