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

C7H9N3O — CID 84763250

IUPAC4-(1-aminocyclopropyl)-1H-pyridazin-6-one
SMILESNC1(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C7H9N3O/c8-7(1-2-7)5-3-6(11)10-9-4-5/h3-4H,1-2,8H2,(H,10,11)
InChIKeyXOFUMRMQEKTXRP-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.28
Rot. Bonds1

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

4-(1-aminocyclopropyl)-1H-pyridazin-6-one (PubChem CID 84763250) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 4-(1-aminocyclopropyl)-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-(1-aminocyclopropyl)-1H-pyridazin-6-one
PubChem CID84763250
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name4-(1-aminocyclopropyl)-1H-pyridazin-6-one
SMILESNC1(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C7H9N3O/c8-7(1-2-7)5-3-6(11)10-9-4-5/h3-4H,1-2,8H2,(H,10,11)
InChIKeyXOFUMRMQEKTXRP-UHFFFAOYSA-N
XLogP-0.28
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethylpyridazin-3(2H)-one
CID 327042
5-Isopropylpyridazin-3(2H)-one
CID 19915065
5-Propyl-2,3-dihydropyridazin-3-one
CID 20061671
4-pentyl-1H-pyridazin-6-one
CID 69021333
4-(2-methylbutan-2-yl)-1H-pyridazin-6-one
CID 90688316
4-(cyclopropylmethyl)-1H-pyridazin-6-one
CID 90901052
5-Cyclopropylpyridazin-3(2H)-one
CID 106516162
4-(1-methylcyclopropyl)-1H-pyridazin-6-one
CID 170429115
4-prop-2-enyl-1H-pyridazin-6-one
CID 173016587
4-butyl-1H-pyridazin-6-one
CID 55269829
4-(2-methylpropyl)-1H-pyridazin-6-one
CID 55269830
5-(1-Aminocyclopropyl)-2-ethylpyridazin-3-one
CID 84767900

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminocyclopropyl)-1H-pyridazin-6-one?
The IUPAC name of 4-(1-aminocyclopropyl)-1H-pyridazin-6-one (CID 84763250) is 4-(1-aminocyclopropyl)-1H-pyridazin-6-one.
What is the SMILES notation for 4-(1-aminocyclopropyl)-1H-pyridazin-6-one?
The canonical SMILES for 4-(1-aminocyclopropyl)-1H-pyridazin-6-one is NC1(c2cn[nH]c(=O)c2)CC1.
What is the InChIKey of 4-(1-aminocyclopropyl)-1H-pyridazin-6-one?
The InChIKey is XOFUMRMQEKTXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c8-7(1-2-7)5-3-6(11)10-9-4-5/h3-4H,1-2,8H2,(H,10,11).
What are the key properties of 4-(1-aminocyclopropyl)-1H-pyridazin-6-one?
4-(1-aminocyclopropyl)-1H-pyridazin-6-one has a molecular weight of 151.17 g/mol, XLogP of -0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminocyclopropyl)-1H-pyridazin-6-one is sourced from PubChem (CID 84763250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).