3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide

C11H16N4O2 — CID 108887356

IUPAC3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)Nc2ccc(=O)[nH]n2)C1
InChIInChI=1S/C11H16N4O2/c1-8-3-2-6-15(7-8)11(17)12-9-4-5-10(16)14-13-9/h4-5,8H,2-3,6-7H2,1H3,(H,14,16)(H,12,13,17)
InChIKeyYUIDNPWFBDACBQ-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.03
Rot. Bonds1

About 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide

3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide (PubChem CID 108887356) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
PubChem CID108887356
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)Nc2ccc(=O)[nH]n2)C1
InChIInChI=1S/C11H16N4O2/c1-8-3-2-6-15(7-8)11(17)12-9-4-5-10(16)14-13-9/h4-5,8H,2-3,6-7H2,1H3,(H,14,16)(H,12,13,17)
InChIKeyYUIDNPWFBDACBQ-UHFFFAOYSA-N
XLogP1.03
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide (CID 108887356) is 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide is CC1CCCN(C(=O)Nc2ccc(=O)[nH]n2)C1.
What is the InChIKey of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide?
The InChIKey is YUIDNPWFBDACBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-8-3-2-6-15(7-8)11(17)12-9-4-5-10(16)14-13-9/h4-5,8H,2-3,6-7H2,1H3,(H,14,16)(H,12,13,17).
What are the key properties of 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide?
3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 1.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 108887356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).