6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one

C7H7N3O — CID 139360753

IUPAC6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one
SMILESCN1Cc2nnccc2C1=O
InChIInChI=1S/C7H7N3O/c1-10-4-6-5(7(10)11)2-3-8-9-6/h2-3H,4H2,1H3
InChIKeyZYVPHUSQWQVNKY-UHFFFAOYSA-N
MW149.15 g/mol
LogP0.06
Rot. Bonds

About 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one

6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one (PubChem CID 139360753) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one.

Molecular Properties

Compound Name6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one
PubChem CID139360753
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one
SMILESCN1Cc2nnccc2C1=O
InChIInChI=1S/C7H7N3O/c1-10-4-6-5(7(10)11)2-3-8-9-6/h2-3H,4H2,1H3
InChIKeyZYVPHUSQWQVNKY-UHFFFAOYSA-N
XLogP0.06
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-6-methyl-7H-pyrrolo[3,4-b]pyridin-5-one
CID 138506545
6-methyl-2-methylsulfanyl-7H-pyrrolo[3,4-d]pyrimidin-5-one
CID 67821056
2-chloro-7-fluoro-4-methyl-3H-1,4-benzodiazepin-5-one
CID 10857165
2-methyl-6-sulfanyl-3H-isoindol-1-one
CID 146588374
ethane;2-methyl-3H-isoindol-1-one;propane
CID 171626915
3,5-dimethyl-4H-thieno[3,4-c]pyrrol-6-one;ethane
CID 167508069
3,5-dimethyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one
CID 20523282
ethane;6-methyl-5H-pyrrolo[3,4-b]pyridin-7-one
CID 162520423
6-tert-butyl-2-methyl-3H-isoindol-1-one
CID 58124079
6-(5-amino-1-methylpyrazol-3-yl)-2-methyl-3H-isoindol-1-one
CID 117357788
7-bromo-2-methoxy-4-methyl-3H-1,4-benzodiazepin-5-one
CID 102353279
3-(4-methyl-2,5-dioxo-3H-1,4-benzodiazepin-1-yl)propanoic acid
CID 10849046

Frequently Asked Questions

What is the IUPAC name of 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one?
The IUPAC name of 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one (CID 139360753) is 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one.
What is the SMILES notation for 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one?
The canonical SMILES for 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one is CN1Cc2nnccc2C1=O.
What is the InChIKey of 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one?
The InChIKey is ZYVPHUSQWQVNKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c1-10-4-6-5(7(10)11)2-3-8-9-6/h2-3H,4H2,1H3.
What are the key properties of 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one?
6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one has a molecular weight of 149.15 g/mol, XLogP of 0.06, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-7H-pyrrolo[3,4-c]pyridazin-5-one is sourced from PubChem (CID 139360753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).