3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)

C8H6N3ORb — CID 177000099

IUPAC3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)
SMILESCc1cc2cnncc2[n-]c1=O.[Rb+]
InChIInChI=1S/C8H7N3O.Rb/c1-5-2-6-3-9-10-4-7(6)11-8(5)12;/h2-4H,1H3,(H,9,11,12);/q;+1/p-1
InChIKeyMMKMDCLAYBDVRF-UHFFFAOYSA-M
MW245.62 g/mol
LogP-2.74
Rot. Bonds

About 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)

3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+) (PubChem CID 177000099) has the molecular formula C8H6N3ORb and a molecular weight of 245.62 g/mol. Its IUPAC name is 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+).

Molecular Properties

Compound Name3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)
PubChem CID177000099
Molecular FormulaC8H6N3ORb
Molecular Weight245.62 g/mol
Exact Mass244.96
IUPAC Name3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)
SMILESCc1cc2cnncc2[n-]c1=O.[Rb+]
InChIInChI=1S/C8H7N3O.Rb/c1-5-2-6-3-9-10-4-7(6)11-8(5)12;/h2-4H,1H3,(H,9,11,12);/q;+1/p-1
InChIKeyMMKMDCLAYBDVRF-UHFFFAOYSA-M
XLogP-2.74
TPSA56.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.62
LogP ≤ 5-2.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrido[2,3-d]pyridazinone
CID 18186441
1-Methylpyrido[2,3-d]pyridazin-2-one
CID 67003493
2-Oxo-1-propylpyrido[2,3-d]pyridazine-3-carboxamide
CID 178537243
2-oxo-1H-pyrido[2,3-d]pyridazine-3-carboxamide
CID 178537248
1-Methyl-2-oxopyrido[2,3-d]pyridazine-3-carboxamide
CID 178537267
1,2-Dihydropyrido[2,3-d]pyridazine-3-carboxamide
CID 178537285
1-Ethyl-2-oxopyrido[2,3-d]pyridazine-3-carboxamide
CID 178537293
3-methyl-1H-pyrido[2,3-d]pyridazin-2-one
CID 177000100
CID 179082109
CID 179082109
CID 179082131
CID 179082131

Frequently Asked Questions

What is the IUPAC name of 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)?
The IUPAC name of 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+) (CID 177000099) is 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+).
What is the SMILES notation for 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)?
The canonical SMILES for 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+) is Cc1cc2cnncc2[n-]c1=O.[Rb+].
What is the InChIKey of 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)?
The InChIKey is MMKMDCLAYBDVRF-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H7N3O.Rb/c1-5-2-6-3-9-10-4-7(6)11-8(5)12;/h2-4H,1H3,(H,9,11,12);/q;+1/p-1.
What are the key properties of 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+)?
3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+) has a molecular weight of 245.62 g/mol, XLogP of -2.74, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylpyrido[2,3-d]pyridazin-1-id-2-one;rubidium(1+) is sourced from PubChem (CID 177000099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).