1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide

C11H15N5O3 — CID 108887466

IUPAC1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)Nc2ccc(=O)[nH]n2)CC1
InChIInChI=1S/C11H15N5O3/c12-10(18)7-3-5-16(6-4-7)11(19)13-8-1-2-9(17)15-14-8/h1-2,7H,3-6H2,(H2,12,18)(H,15,17)(H,13,14,19)
InChIKeyULHDVGJSGVCVGR-UHFFFAOYSA-N
MW265.27 g/mol
LogP-0.50
Rot. Bonds2

About 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide

1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide (PubChem CID 108887466) has the molecular formula C11H15N5O3 and a molecular weight of 265.27 g/mol. Its IUPAC name is 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide
PubChem CID108887466
Molecular FormulaC11H15N5O3
Molecular Weight265.27 g/mol
Exact Mass265.12
IUPAC Name1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)Nc2ccc(=O)[nH]n2)CC1
InChIInChI=1S/C11H15N5O3/c12-10(18)7-3-5-16(6-4-7)11(19)13-8-1-2-9(17)15-14-8/h1-2,7H,3-6H2,(H2,12,18)(H,15,17)(H,13,14,19)
InChIKeyULHDVGJSGVCVGR-UHFFFAOYSA-N
XLogP-0.50
TPSA121.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide (CID 108887466) is 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide is NC(=O)C1CCN(C(=O)Nc2ccc(=O)[nH]n2)CC1.
What is the InChIKey of 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide?
The InChIKey is ULHDVGJSGVCVGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O3/c12-10(18)7-3-5-16(6-4-7)11(19)13-8-1-2-9(17)15-14-8/h1-2,7H,3-6H2,(H2,12,18)(H,15,17)(H,13,14,19).
What are the key properties of 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide?
1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide has a molecular weight of 265.27 g/mol, XLogP of -0.50, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 108887466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).