2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide

C11H16N4O2 — CID 116786879

IUPAC2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide
SMILESCC1(C(=O)Nc2ccc(=O)[nH]n2)CCCCN1
InChIInChI=1S/C11H16N4O2/c1-11(6-2-3-7-12-11)10(17)13-8-4-5-9(16)15-14-8/h4-5,12H,2-3,6-7H2,1H3,(H,15,16)(H,13,14,17)
InChIKeyJCFIZCQIHANCJJ-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.24
Rot. Bonds2

About 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide

2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide (PubChem CID 116786879) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide
PubChem CID116786879
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide
SMILESCC1(C(=O)Nc2ccc(=O)[nH]n2)CCCCN1
InChIInChI=1S/C11H16N4O2/c1-11(6-2-3-7-12-11)10(17)13-8-4-5-9(16)15-14-8/h4-5,12H,2-3,6-7H2,1H3,(H,15,16)(H,13,14,17)
InChIKeyJCFIZCQIHANCJJ-UHFFFAOYSA-N
XLogP0.24
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
CID 113357162
2-methyl-N-(3-methyl-2-pyridinyl)piperidine-2-carboxamide
CID 104596093
(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 59436345
2-methyl-N-pyridazin-3-ylpyrrolidine-2-carboxamide
CID 116786688
N-(2-chloro-5-fluorophenyl)-2-methylpiperidine-2-carboxamide
CID 107528549
2-methyl-N-(4-methyl-3-pyridinyl)piperidine-2-carboxamide
CID 113368673
2-methyl-N-(2,3,4,5,6-pentafluorophenyl)piperidine-2-carboxamide
CID 104597136
N-(2,3-dimethylphenyl)-2-methylpiperidine-2-carboxamide
CID 113368535
N-(3-carbamoyl-2-methylphenyl)-2-methylpiperidine-2-carboxamide
CID 104596248
4-bromo-2-[(2-methylpiperidine-2-carbonyl)amino]benzoic acid
CID 104596607
2-methyl-N-naphthalen-1-ylpiperidine-2-carboxamide
CID 104596031
N-(5-chloro-2-methylphenyl)-2-methylpiperidine-2-carboxamide
CID 113368554

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide?
The IUPAC name of 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide (CID 116786879) is 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide.
What is the SMILES notation for 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide?
The canonical SMILES for 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide is CC1(C(=O)Nc2ccc(=O)[nH]n2)CCCCN1.
What is the InChIKey of 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide?
The InChIKey is JCFIZCQIHANCJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-11(6-2-3-7-12-11)10(17)13-8-4-5-9(16)15-14-8/h4-5,12H,2-3,6-7H2,1H3,(H,15,16)(H,13,14,17).
What are the key properties of 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide?
2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 0.24, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide is sourced from PubChem (CID 116786879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).