1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one

C6H6N4O — CID 154673871

IUPAC1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one
SMILESCn1ncc2c(=O)cn[nH]c21
InChIInChI=1S/C6H6N4O/c1-10-6-4(2-8-10)5(11)3-7-9-6/h2-3H,1H3,(H,9,11)
InChIKeyZKBLDRTUGJPKLR-UHFFFAOYSA-N
MW150.14 g/mol
LogP-0.34
Rot. Bonds

About 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one

1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one (PubChem CID 154673871) has the molecular formula C6H6N4O and a molecular weight of 150.14 g/mol. Its IUPAC name is 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one.

Molecular Properties

Compound Name1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one
PubChem CID154673871
Molecular FormulaC6H6N4O
Molecular Weight150.14 g/mol
Exact Mass150.05
IUPAC Name1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one
SMILESCn1ncc2c(=O)cn[nH]c21
InChIInChI=1S/C6H6N4O/c1-10-6-4(2-8-10)5(11)3-7-9-6/h2-3H,1H3,(H,9,11)
InChIKeyZKBLDRTUGJPKLR-UHFFFAOYSA-N
XLogP-0.34
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-Methyl-7H-pyrazolo(3,4-d)(1,2,3)triazin-4-ol
CID 135495349
5-amino-1-methyl-1H-pyrazole-4-carboxamide
CID 265696
1-(5-Amino-1-methyl-1H-pyrazol-4-yl)ethan-1-one
CID 11412428
6-Methyl-3H-pyrazolo[3,4-d]triazin-4-one
CID 135445606
1-(3-amino-1-isopropyl-1H-pyrazol-4-yl)ethanone
CID 51034229
1H-pyrazolo[3,4-b]pyridin-4-ol
CID 135741602
1,7-Dihydro-7-methyl-4H-pyrazolo(3,4-d)-1,2,3-triazin-4-one 2-oxide
CID 136171145
1-[3-Amino-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]ethanone
CID 126498078
1-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-4-one
CID 155025254
6-Amino-1H-pyrazolo[3,4-b]pyridin-4(2H)-one
CID 135468205
1-(5-Amino-1-methylpyrazol-4-yl)-2,2,2-trifluoroethanone
CID 66467915
1-(5-Amino-1-propan-2-ylpyrazol-4-yl)-2,2,2-trifluoroethanone
CID 121597164

Frequently Asked Questions

What is the IUPAC name of 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one?
The IUPAC name of 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one (CID 154673871) is 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one.
What is the SMILES notation for 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one?
The canonical SMILES for 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one is Cn1ncc2c(=O)cn[nH]c21.
What is the InChIKey of 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one?
The InChIKey is ZKBLDRTUGJPKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O/c1-10-6-4(2-8-10)5(11)3-7-9-6/h2-3H,1H3,(H,9,11).
What are the key properties of 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one?
1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one has a molecular weight of 150.14 g/mol, XLogP of -0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7H-pyrazolo[5,4-c]pyridazin-4-one is sourced from PubChem (CID 154673871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).