N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide

C19H26N6O2 — CID 136579663

About N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide

N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide (PubChem CID 136579663) has the molecular formula C19H26N6O2 and a molecular weight of 370.46 g/mol. Its IUPAC name is N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide.

Molecular Properties

• Compound Name: N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide
• PubChem CID: 136579663
• Molecular Formula: C19H26N6O2
• Molecular Weight: 370.46 g/mol
• Exact Mass: 370.21
• IUPAC Name: N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide
• SMILES: CCCCc1cc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)n[nH]1
• InChI: InChI=1S/C19H26N6O2/c1-5-6-7-13-10-15(23-22-13)20-16(26)9-8-14-11(2)17-12(3)24-25(4)18(17)21-19(14)27/h10H,5-9H2,1-4H3,(H,21,27)(H2,20,22,23,26)
• InChIKey: OFDOSXMZUFMGDJ-UHFFFAOYSA-N
• XLogP: 2.52
• TPSA: 108.46 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	370.46
LogP ≤ 5	2.52
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide?

The IUPAC name of N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide (CID 136579663) is N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide.

What is the SMILES notation for N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide?

The canonical SMILES for N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide is CCCCc1cc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)n[nH]1.

What is the InChIKey of N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide?

The InChIKey is OFDOSXMZUFMGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O2/c1-5-6-7-13-10-15(23-22-13)20-16(26)9-8-14-11(2)17-12(3)24-25(4)18(17)21-19(14)27/h10H,5-9H2,1-4H3,(H,21,27)(H2,20,22,23,26).

What are the key properties of N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide?

N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide has a molecular weight of 370.46 g/mol, XLogP of 2.52, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-butyl-1H-pyrazol-3-yl)-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide is sourced from PubChem (CID 136579663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).