4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide

C13H20N4O2 — CID 56894429

IUPAC4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide
SMILESNC(=O)CCCn1ncc(N2CCCCC2)cc1=O
InChIInChI=1S/C13H20N4O2/c14-12(18)5-4-8-17-13(19)9-11(10-15-17)16-6-2-1-3-7-16/h9-10H,1-8H2,(H2,14,18)
InChIKeyMPWWREKSASCFNL-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.50
Rot. Bonds5

About 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide

4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide (PubChem CID 56894429) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide.

Molecular Properties

Compound Name4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide
PubChem CID56894429
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide
SMILESNC(=O)CCCn1ncc(N2CCCCC2)cc1=O
InChIInChI=1S/C13H20N4O2/c14-12(18)5-4-8-17-13(19)9-11(10-15-17)16-6-2-1-3-7-16/h9-10H,1-8H2,(H2,14,18)
InChIKeyMPWWREKSASCFNL-UHFFFAOYSA-N
XLogP0.50
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]propanamide
CID 56910372
N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
CID 91924008
N-(3-methylbutyl)-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
CID 53202012
1-(6-oxo-1H-pyridazin-4-yl)-N-pentan-3-ylpiperidine-4-carboxamide
CID 53202016
N-cyclopentyl-1-(6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidinecarboxamide
CID 53202029
N-butyl-N-methyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
CID 53202047
4-[4-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]-1H-pyridazin-6-one
CID 53202050
N-(2-methylpropyl)-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
CID 53202052
4-[4-(3-methylpiperidine-1-carbonyl)piperidin-1-yl]-1H-pyridazin-6-one
CID 53202063
N-(3-methylbutyl)-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-4-carboxamide
CID 53202079
N-cyclopropyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-4-carboxamide
CID 53202100
N-butyl-N-methyl-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-4-carboxamide
CID 53202111

Frequently Asked Questions

What is the IUPAC name of 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide?
The IUPAC name of 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide (CID 56894429) is 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide.
What is the SMILES notation for 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide?
The canonical SMILES for 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide is NC(=O)CCCn1ncc(N2CCCCC2)cc1=O.
What is the InChIKey of 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide?
The InChIKey is MPWWREKSASCFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c14-12(18)5-4-8-17-13(19)9-11(10-15-17)16-6-2-1-3-7-16/h9-10H,1-8H2,(H2,14,18).
What are the key properties of 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide?
4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide has a molecular weight of 264.33 g/mol, XLogP of 0.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-oxo-4-piperidin-1-ylpyridazin-1-yl)butanamide is sourced from PubChem (CID 56894429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).