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

C14H22N4O2 — CID 91924008

IUPACN-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
SMILESCCCCC(=O)NC1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C14H22N4O2/c1-2-3-4-13(19)16-11-5-7-18(8-6-11)12-9-14(20)17-15-10-12/h9-11H,2-8H2,1H3,(H,16,19)(H,17,20)
InChIKeySNMBIOFSXYKEFI-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.05
Rot. Bonds5

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

N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide (PubChem CID 91924008) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide.

Molecular Properties

Compound NameN-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
PubChem CID91924008
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide
SMILESCCCCC(=O)NC1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C14H22N4O2/c1-2-3-4-13(19)16-11-5-7-18(8-6-11)12-9-14(20)17-15-10-12/h9-11H,2-8H2,1H3,(H,16,19)(H,17,20)
InChIKeySNMBIOFSXYKEFI-UHFFFAOYSA-N
XLogP1.05
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
The IUPAC name of N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide (CID 91924008) is N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide.
What is the SMILES notation for N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
The canonical SMILES for N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide is CCCCC(=O)NC1CCN(c2cn[nH]c(=O)c2)CC1.
What is the InChIKey of N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
The InChIKey is SNMBIOFSXYKEFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-2-3-4-13(19)16-11-5-7-18(8-6-11)12-9-14(20)17-15-10-12/h9-11H,2-8H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide?
N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide has a molecular weight of 278.36 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-oxo-1H-pyridazin-4-yl)piperidin-4-yl]pentanamide is sourced from PubChem (CID 91924008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).