4-cyclopropyl-3-methyl-1H-pyridazin-6-one

C8H10N2O — CID 176719729

IUPAC4-cyclopropyl-3-methyl-1H-pyridazin-6-one
SMILESCc1n[nH]c(=O)cc1C1CC1
InChIInChI=1S/C8H10N2O/c1-5-7(6-2-3-6)4-8(11)10-9-5/h4,6H,2-3H2,1H3,(H,10,11)
InChIKeyNESMREXEOPTUDV-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.96
Rot. Bonds1

About 4-cyclopropyl-3-methyl-1H-pyridazin-6-one

4-cyclopropyl-3-methyl-1H-pyridazin-6-one (PubChem CID 176719729) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 4-cyclopropyl-3-methyl-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-cyclopropyl-3-methyl-1H-pyridazin-6-one
PubChem CID176719729
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name4-cyclopropyl-3-methyl-1H-pyridazin-6-one
SMILESCc1n[nH]c(=O)cc1C1CC1
InChIInChI=1S/C8H10N2O/c1-5-7(6-2-3-6)4-8(11)10-9-5/h4,6H,2-3H2,1H3,(H,10,11)
InChIKeyNESMREXEOPTUDV-UHFFFAOYSA-N
XLogP0.96
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 ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,5,6,7,8-Hexahydrocinnolin-3-one
CID 230473
5,6-Dimethylpyridazin-3-ol
CID 50987709
6-Cyclopropyl-2,3-dihydropyridazin-3-one
CID 53402962
(4E)-4-(cyclohex-3-en-1-ylmethylidene)-3-methyl-1H-pyrazol-5-one
CID 6391620
6-Tert-butyl-5-methyl-2,3-dihydropyridazin-3-one
CID 131701591
3-propan-2-yl-4-(trifluoromethyl)-1H-pyridazin-6-one
CID 138551387
4-(difluoromethyl)-3-propan-2-yl-1H-pyridazin-6-one
CID 141654353
3-(3-fluoro-6-methylcyclohexa-1,3-dien-1-yl)-1H-pyridazin-6-one
CID 163917233
2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
CID 14363895
5,6,7,8,9,10,11,12,13,14-Decahydrocyclododeca[c]pyridazin-3(2H)-one
CID 20441610
5-Methyl-6-(3,3,3-trifluoropropyl)-2,3-dihydropyridazin-3-one
CID 131701596
3-(2-methylpropyl)-1H-pyridazin-6-one
CID 13735304

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-3-methyl-1H-pyridazin-6-one?
The IUPAC name of 4-cyclopropyl-3-methyl-1H-pyridazin-6-one (CID 176719729) is 4-cyclopropyl-3-methyl-1H-pyridazin-6-one.
What is the SMILES notation for 4-cyclopropyl-3-methyl-1H-pyridazin-6-one?
The canonical SMILES for 4-cyclopropyl-3-methyl-1H-pyridazin-6-one is Cc1n[nH]c(=O)cc1C1CC1.
What is the InChIKey of 4-cyclopropyl-3-methyl-1H-pyridazin-6-one?
The InChIKey is NESMREXEOPTUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-5-7(6-2-3-6)4-8(11)10-9-5/h4,6H,2-3H2,1H3,(H,10,11).
What are the key properties of 4-cyclopropyl-3-methyl-1H-pyridazin-6-one?
4-cyclopropyl-3-methyl-1H-pyridazin-6-one has a molecular weight of 150.18 g/mol, XLogP of 0.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-3-methyl-1H-pyridazin-6-one is sourced from PubChem (CID 176719729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).