N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide

C19H24N6O2 — CID 122280803

About N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide

N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide (PubChem CID 122280803) has the molecular formula C19H24N6O2 and a molecular weight of 368.44 g/mol. Its IUPAC name is N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide
• PubChem CID: 122280803
• Molecular Formula: C19H24N6O2
• Molecular Weight: 368.44 g/mol
• Exact Mass: 368.20
• IUPAC Name: N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide
• SMILES: O=C(NCCn1nc2c(cc1=O)CCC2)c1ccc(N2CCCCC2)nn1
• InChI: InChI=1S/C19H24N6O2/c26-18-13-14-5-4-6-15(14)23-25(18)12-9-20-19(27)16-7-8-17(22-21-16)24-10-2-1-3-11-24/h7-8,13H,1-6,9-12H2,(H,20,27)
• InChIKey: LSYLSLAMCMFPOV-UHFFFAOYSA-N
• XLogP: 0.94
• TPSA: 93.01 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	368.44
LogP ≤ 5	0.94
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide?

The IUPAC name of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide (CID 122280803) is N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide.

What is the SMILES notation for N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide?

The canonical SMILES for N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide is O=C(NCCn1nc2c(cc1=O)CCC2)c1ccc(N2CCCCC2)nn1.

What is the InChIKey of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide?

The InChIKey is LSYLSLAMCMFPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O2/c26-18-13-14-5-4-6-15(14)23-25(18)12-9-20-19(27)16-7-8-17(22-21-16)24-10-2-1-3-11-24/h7-8,13H,1-6,9-12H2,(H,20,27).

What are the key properties of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide?

N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-6-piperidin-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 122280803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).