6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine

C19H23N7 — CID 167828754

About 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine

6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine (PubChem CID 167828754) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine.

Molecular Properties

• Compound Name: 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine
• PubChem CID: 167828754
• Molecular Formula: C19H23N7
• Molecular Weight: 349.44 g/mol
• Exact Mass: 349.20
• IUPAC Name: 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine
• SMILES: Cc1ccn(-c2ccc(NC[C@@H]3CCN(C)[C@H]3c3cccnc3)nn2)n1
• InChI: InChI=1S/C19H23N7/c1-14-7-11-26(24-14)18-6-5-17(22-23-18)21-13-16-8-10-25(2)19(16)15-4-3-9-20-12-15/h3-7,9,11-12,16,19H,8,10,13H2,1-2H3,(H,21,22)/t16-,19-/m0/s1
• InChIKey: OAHXYYMPGBDIEV-LPHOPBHVSA-N
• XLogP: 2.47
• TPSA: 71.76 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	349.44
LogP ≤ 5	2.47
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine?

The IUPAC name of 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine (CID 167828754) is 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine.

What is the SMILES notation for 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine?

The canonical SMILES for 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine is Cc1ccn(-c2ccc(NC[C@@H]3CCN(C)[C@H]3c3cccnc3)nn2)n1.

What is the InChIKey of 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine?

The InChIKey is OAHXYYMPGBDIEV-LPHOPBHVSA-N. The full InChI is InChI=1S/C19H23N7/c1-14-7-11-26(24-14)18-6-5-17(22-23-18)21-13-16-8-10-25(2)19(16)15-4-3-9-20-12-15/h3-7,9,11-12,16,19H,8,10,13H2,1-2H3,(H,21,22)/t16-,19-/m0/s1.

What are the key properties of 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine?

6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine has a molecular weight of 349.44 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(3-methylpyrazol-1-yl)-N-[[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 167828754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).