4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide

C15H24N4O2 — CID 91924002

IUPAC4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
SMILESCC(C)CCC(=O)NC1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C15H24N4O2/c1-11(2)3-4-14(20)17-12-5-7-19(8-6-12)13-9-15(21)18-16-10-13/h9-12H,3-8H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyXBTAZANIZYITDH-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.29
Rot. Bonds5

About 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide

4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide (PubChem CID 91924002) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide.

Molecular Properties

Compound Name4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
PubChem CID91924002
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
SMILESCC(C)CCC(=O)NC1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C15H24N4O2/c1-11(2)3-4-14(20)17-12-5-7-19(8-6-12)13-9-15(21)18-16-10-13/h9-12H,3-8H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyXBTAZANIZYITDH-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 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
The IUPAC name of 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide (CID 91924002) is 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide.
What is the SMILES notation for 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
The canonical SMILES for 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide is CC(C)CCC(=O)NC1CCN(c2cn[nH]c(=O)c2)CC1.
What is the InChIKey of 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
The InChIKey is XBTAZANIZYITDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11(2)3-4-14(20)17-12-5-7-19(8-6-12)13-9-15(21)18-16-10-13/h9-12H,3-8H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide 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 4-methyl-N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide is sourced from PubChem (CID 91924002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).