(2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone

C15H24N4O — CID 62173358

IUPAC(2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone
SMILESCCCNc1ccc(C(=O)N2C(C)CCCC2C)nn1
InChIInChI=1S/C15H24N4O/c1-4-10-16-14-9-8-13(17-18-14)15(20)19-11(2)6-5-7-12(19)3/h8-9,11-12H,4-7,10H2,1-3H3,(H,16,18)
InChIKeyQWNGNACHONEUMI-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.70
Rot. Bonds4

About (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone

(2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone (PubChem CID 62173358) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone.

Molecular Properties

Compound Name(2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone
PubChem CID62173358
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name(2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone
SMILESCCCNc1ccc(C(=O)N2C(C)CCCC2C)nn1
InChIInChI=1S/C15H24N4O/c1-4-10-16-14-9-8-13(17-18-14)15(20)19-11(2)6-5-7-12(19)3/h8-9,11-12H,4-7,10H2,1-3H3,(H,16,18)
InChIKeyQWNGNACHONEUMI-UHFFFAOYSA-N
XLogP2.70
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

piperidin-1-yl-[6-(propylamino)pyridazin-3-yl]methanone
CID 55042849
(4-hydroxypiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone
CID 55042518
[(2S,6R)-2,6-dimethylpiperidin-1-yl]-[2-(propylamino)-4-pyridinyl]methanone
CID 104968822
(4-cyclopropylpiperazin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone
CID 62177839
(3-methylmorpholin-4-yl)-[6-(propylamino)pyridazin-3-yl]methanone
CID 62169207
[6-(propylamino)pyridazin-3-yl]-(2-propylpiperidin-1-yl)methanone
CID 83046126
[6-(propylamino)pyridazin-3-yl]-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 114596505
[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-[6-(propylamino)pyridazin-3-yl]methanone
CID 81212909
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
[6-(ethylamino)pyridazin-3-yl]-(3-methylpiperidin-1-yl)methanone
CID 62172058
[5-bromo-2-(propylamino)-3-pyridinyl]-[(2S,6R)-2,6-dimethylpiperidin-1-yl]methanone
CID 104968772
N-(2-cyclopentyloxyethyl)-6-(propylamino)pyridazine-3-carboxamide
CID 63832896

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
The IUPAC name of (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone (CID 62173358) is (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone.
What is the SMILES notation for (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
The canonical SMILES for (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone is CCCNc1ccc(C(=O)N2C(C)CCCC2C)nn1.
What is the InChIKey of (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
The InChIKey is QWNGNACHONEUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-10-16-14-9-8-13(17-18-14)15(20)19-11(2)6-5-7-12(19)3/h8-9,11-12H,4-7,10H2,1-3H3,(H,16,18).
What are the key properties of (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone?
(2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone has a molecular weight of 276.38 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylpiperidin-1-yl)-[6-(propylamino)pyridazin-3-yl]methanone is sourced from PubChem (CID 62173358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).