7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine

C20H17N7 — CID 158554210

About 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine

7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine (PubChem CID 158554210) has the molecular formula C20H17N7 and a molecular weight of 355.41 g/mol. Its IUPAC name is 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine.

Molecular Properties

• Compound Name: 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine
• PubChem CID: 158554210
• Molecular Formula: C20H17N7
• Molecular Weight: 355.41 g/mol
• Exact Mass: 355.15
• IUPAC Name: 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine
• SMILES: Nc1nc2cc(-c3ccn[nH]3)ccc2c2cn(CCc3ccccn3)nc12
• InChI: InChI=1S/C20H17N7/c21-20-19-16(12-27(26-19)10-7-14-3-1-2-8-22-14)15-5-4-13(11-18(15)24-20)17-6-9-23-25-17/h1-6,8-9,11-12H,7,10H2,(H2,21,24)(H,23,25)
• InChIKey: HQBTZJYVUIYUSP-UHFFFAOYSA-N
• XLogP: 3.19
• TPSA: 98.30 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.41
LogP ≤ 5	3.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine?

The IUPAC name of 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine (CID 158554210) is 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine.

What is the SMILES notation for 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine?

The canonical SMILES for 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine is Nc1nc2cc(-c3ccn[nH]3)ccc2c2cn(CCc3ccccn3)nc12.

What is the InChIKey of 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine?

The InChIKey is HQBTZJYVUIYUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N7/c21-20-19-16(12-27(26-19)10-7-14-3-1-2-8-22-14)15-5-4-13(11-18(15)24-20)17-6-9-23-25-17/h1-6,8-9,11-12H,7,10H2,(H2,21,24)(H,23,25).

What are the key properties of 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine?

7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine has a molecular weight of 355.41 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(1H-pyrazol-5-yl)-2-(2-pyridin-2-ylethyl)pyrazolo[3,4-c]quinolin-4-amine is sourced from PubChem (CID 158554210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).