1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide

C15H24N4O2 — CID 53202016

IUPAC1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide
SMILESCCC(CC)NC(=O)C1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C15H24N4O2/c1-3-12(4-2)17-15(21)11-5-7-19(8-6-11)13-9-14(20)18-16-10-13/h9-12H,3-8H2,1-2H3,(H,17,21)(H,18,20)
InChIKeyXUEWYOHENBINNM-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.29
Rot. Bonds5

About 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide

1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide (PubChem CID 53202016) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide
PubChem CID53202016
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide
SMILESCCC(CC)NC(=O)C1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C15H24N4O2/c1-3-12(4-2)17-15(21)11-5-7-19(8-6-11)13-9-14(20)18-16-10-13/h9-12H,3-8H2,1-2H3,(H,17,21)(H,18,20)
InChIKeyXUEWYOHENBINNM-UHFFFAOYSA-N
XLogP1.29
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide (CID 53202016) is 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide is CCC(CC)NC(=O)C1CCN(c2cn[nH]c(=O)c2)CC1.
What is the InChIKey of 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide?
The InChIKey is XUEWYOHENBINNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-3-12(4-2)17-15(21)11-5-7-19(8-6-11)13-9-14(20)18-16-10-13/h9-12H,3-8H2,1-2H3,(H,17,21)(H,18,20).
What are the key properties of 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide?
1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide is sourced from PubChem (CID 53202016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).