1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide

C16H19N5O2 — CID 24612235

IUPAC1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide
SMILESCn1nc(C(=O)Nc2ccc(N3CCCCC3)nc2)ccc1=O
InChIInChI=1S/C16H19N5O2/c1-20-15(22)8-6-13(19-20)16(23)18-12-5-7-14(17-11-12)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,18,23)
InChIKeyWMJBUPMVLHCYJC-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.42
Rot. Bonds3

About 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide

1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide (PubChem CID 24612235) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide
PubChem CID24612235
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC Name1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide
SMILESCn1nc(C(=O)Nc2ccc(N3CCCCC3)nc2)ccc1=O
InChIInChI=1S/C16H19N5O2/c1-20-15(22)8-6-13(19-20)16(23)18-12-5-7-14(17-11-12)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,18,23)
InChIKeyWMJBUPMVLHCYJC-UHFFFAOYSA-N
XLogP1.42
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-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 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide?
The IUPAC name of 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide (CID 24612235) is 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide.
What is the SMILES notation for 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide?
The canonical SMILES for 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide is Cn1nc(C(=O)Nc2ccc(N3CCCCC3)nc2)ccc1=O.
What is the InChIKey of 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide?
The InChIKey is WMJBUPMVLHCYJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c1-20-15(22)8-6-13(19-20)16(23)18-12-5-7-14(17-11-12)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,18,23).
What are the key properties of 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide?
1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-oxo-N-(6-piperidin-1-yl-3-pyridinyl)pyridazine-3-carboxamide is sourced from PubChem (CID 24612235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).