1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide

C15H20N6O2 — CID 71795331

IUPAC1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
SMILESCc1cc(NC(=O)C2CCN(c3ccc(=O)n(C)n3)CC2)n[nH]1
InChIInChI=1S/C15H20N6O2/c1-10-9-12(18-17-10)16-15(23)11-5-7-21(8-6-11)13-3-4-14(22)20(2)19-13/h3-4,9,11H,5-8H2,1-2H3,(H2,16,17,18,23)
InChIKeyVHLQFSIXULIFAY-UHFFFAOYSA-N
MW316.37 g/mol
LogP0.67
Rot. Bonds3

About 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide

1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide (PubChem CID 71795331) has the molecular formula C15H20N6O2 and a molecular weight of 316.37 g/mol. Its IUPAC name is 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
PubChem CID71795331
Molecular FormulaC15H20N6O2
Molecular Weight316.37 g/mol
Exact Mass316.16
IUPAC Name1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
SMILESCc1cc(NC(=O)C2CCN(c3ccc(=O)n(C)n3)CC2)n[nH]1
InChIInChI=1S/C15H20N6O2/c1-10-9-12(18-17-10)16-15(23)11-5-7-21(8-6-11)13-3-4-14(22)20(2)19-13/h3-4,9,11H,5-8H2,1-2H3,(H2,16,17,18,23)
InChIKeyVHLQFSIXULIFAY-UHFFFAOYSA-N
XLogP0.67
TPSA95.91 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide (CID 71795331) is 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide is Cc1cc(NC(=O)C2CCN(c3ccc(=O)n(C)n3)CC2)n[nH]1.
What is the InChIKey of 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
The InChIKey is VHLQFSIXULIFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O2/c1-10-9-12(18-17-10)16-15(23)11-5-7-21(8-6-11)13-3-4-14(22)20(2)19-13/h3-4,9,11H,5-8H2,1-2H3,(H2,16,17,18,23).
What are the key properties of 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide?
1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide has a molecular weight of 316.37 g/mol, XLogP of 0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-6-oxopyridazin-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 71795331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).