5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one

C13H13N3O2 — CID 10377117

IUPAC5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one
SMILESCN1N=C(c2ccc3c(c2)CC(=O)N3)CCC1=O
InChIInChI=1S/C13H13N3O2/c1-16-13(18)5-4-11(15-16)8-2-3-10-9(6-8)7-12(17)14-10/h2-3,6H,4-5,7H2,1H3,(H,14,17)
InChIKeyIFODBCIMPVCDMS-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.14
Rot. Bonds1

About 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one

5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one (PubChem CID 10377117) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one
PubChem CID10377117
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one
SMILESCN1N=C(c2ccc3c(c2)CC(=O)N3)CCC1=O
InChIInChI=1S/C13H13N3O2/c1-16-13(18)5-4-11(15-16)8-2-3-10-9(6-8)7-12(17)14-10/h2-3,6H,4-5,7H2,1H3,(H,14,17)
InChIKeyIFODBCIMPVCDMS-UHFFFAOYSA-N
XLogP1.14
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Indolidan
CID 5284402
OR-1896
CID 9816296
3-(4-Methylanilino)indol-2-one
CID 135412515
2-Indolinone, 3-(phenylimino)-
CID 135442567
3-(diphenylhydrazinylidene)-1,3-dihydro-2H-indol-2-one
CID 135439090
3,3-dimethyl-5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-indol-2-one
CID 10084561
7-Methyl-3-p-tolylimino-1,3-dihydro-indol-2-one
CID 135495650
(3Z)-3-[(2,4,6-trimethylphenyl)imino]-1,3-dihydro-2H-indol-2-one
CID 135406219
2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-
CID 184661
6-methyl-5-(2-oxospiro[1H-indole-3,1'-cyclopropane]-5-yl)-3,6-dihydro-1,3,4-thiadiazin-2-one
CID 9947843
1,3,3-trimethyl-5-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)indol-2-one
CID 9994095
5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)spiro[1H-indole-3,1'-cyclopentane]-2-one
CID 13728290

Frequently Asked Questions

What is the IUPAC name of 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one (CID 10377117) is 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one is CN1N=C(c2ccc3c(c2)CC(=O)N3)CCC1=O.
What is the InChIKey of 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one?
The InChIKey is IFODBCIMPVCDMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-16-13(18)5-4-11(15-16)8-2-3-10-9(6-8)7-12(17)14-10/h2-3,6H,4-5,7H2,1H3,(H,14,17).
What are the key properties of 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one?
5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one has a molecular weight of 243.27 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methyl-6-oxo-4,5-dihydropyridazin-3-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 10377117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).