N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide

C16H19N5O3 — CID 110821459

IUPACN-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide
SMILESO=C1CCC(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)=NN1
InChIInChI=1S/C16H19N5O3/c22-14-5-4-13(19-20-14)16(24)21-9-6-11(7-10-21)18-15(23)12-3-1-2-8-17-12/h1-3,8,11H,4-7,9-10H2,(H,18,23)(H,20,22)
InChIKeySKFXQGNZSSUMFE-UHFFFAOYSA-N
MW329.36 g/mol
LogP0.07
Rot. Bonds3

About N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide

N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide (PubChem CID 110821459) has the molecular formula C16H19N5O3 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide
PubChem CID110821459
Molecular FormulaC16H19N5O3
Molecular Weight329.36 g/mol
Exact Mass329.15
IUPAC NameN-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide
SMILESO=C1CCC(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)=NN1
InChIInChI=1S/C16H19N5O3/c22-14-5-4-13(19-20-14)16(24)21-9-6-11(7-10-21)18-15(23)12-3-1-2-8-17-12/h1-3,8,11H,4-7,9-10H2,(H,18,23)(H,20,22)
InChIKeySKFXQGNZSSUMFE-UHFFFAOYSA-N
XLogP0.07
TPSA103.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-bromobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557809
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557881
N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
N-[1-(3-chlorobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110821025
N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110820295
N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110822407
N-(6-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 62492174
2-fluoro-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 110821143
N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide
CID 69401322
5-bromo-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 108551769
1-(2,2-dimethylpropyl)-3-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]urea
CID 110821499
N-[1-(3-cyanobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110820497

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide (CID 110821459) is N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide is O=C1CCC(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)=NN1.
What is the InChIKey of N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide?
The InChIKey is SKFXQGNZSSUMFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O3/c22-14-5-4-13(19-20-14)16(24)21-9-6-11(7-10-21)18-15(23)12-3-1-2-8-17-12/h1-3,8,11H,4-7,9-10H2,(H,18,23)(H,20,22).
What are the key properties of N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide?
N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 110821459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).