1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide

C11H18N4O2 — CID 47368292

IUPAC1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCN1CCC(NC(=O)C2=NN(C)C(=O)CC2)C1
InChIInChI=1S/C11H18N4O2/c1-14-6-5-8(7-14)12-11(17)9-3-4-10(16)15(2)13-9/h8H,3-7H2,1-2H3,(H,12,17)
InChIKeyZAWDBOBIHLMCKM-UHFFFAOYSA-N
MW238.29 g/mol
LogP-0.59
Rot. Bonds2

About 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide

1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide (PubChem CID 47368292) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
PubChem CID47368292
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
SMILESCN1CCC(NC(=O)C2=NN(C)C(=O)CC2)C1
InChIInChI=1S/C11H18N4O2/c1-14-6-5-8(7-14)12-11(17)9-3-4-10(16)15(2)13-9/h8H,3-7H2,1-2H3,(H,12,17)
InChIKeyZAWDBOBIHLMCKM-UHFFFAOYSA-N
XLogP-0.59
TPSA65.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide (CID 47368292) is 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide is CN1CCC(NC(=O)C2=NN(C)C(=O)CC2)C1.
What is the InChIKey of 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is ZAWDBOBIHLMCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-14-6-5-8(7-14)12-11(17)9-3-4-10(16)15(2)13-9/h8H,3-7H2,1-2H3,(H,12,17).
What are the key properties of 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide?
1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of -0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1-methylpyrrolidin-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 47368292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).