2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide

C19H19N5O — CID 139412402

About 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide

2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide (PubChem CID 139412402) has the molecular formula C19H19N5O and a molecular weight of 333.40 g/mol. Its IUPAC name is 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide.

Molecular Properties

• Compound Name: 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide
• PubChem CID: 139412402
• Molecular Formula: C19H19N5O
• Molecular Weight: 333.40 g/mol
• Exact Mass: 333.16
• IUPAC Name: 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide
• SMILES: Cc1cc(-c2ccc3c(c2)CCC3NC(=O)c2ccnn2C)cnn1
• InChI: InChI=1S/C19H19N5O/c1-12-9-15(11-20-23-12)13-3-5-16-14(10-13)4-6-17(16)22-19(25)18-7-8-21-24(18)2/h3,5,7-11,17H,4,6H2,1-2H3,(H,22,25)
• InChIKey: LVPMTMKPHWUXJX-UHFFFAOYSA-N
• XLogP: 2.60
• TPSA: 72.70 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	333.40
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

The IUPAC name of 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide (CID 139412402) is 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide.

What is the SMILES notation for 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

The canonical SMILES for 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide is Cc1cc(-c2ccc3c(c2)CCC3NC(=O)c2ccnn2C)cnn1.

What is the InChIKey of 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

The InChIKey is LVPMTMKPHWUXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O/c1-12-9-15(11-20-23-12)13-3-5-16-14(10-13)4-6-17(16)22-19(25)18-7-8-21-24(18)2/h3,5,7-11,17H,4,6H2,1-2H3,(H,22,25).

What are the key properties of 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide has a molecular weight of 333.40 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-N-[5-(6-methylpyridazin-4-yl)-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 139412402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).