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

C20H18N8 — CID 155679567

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

7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine (PubChem CID 155679567) has the molecular formula C20H18N8 and a molecular weight of 370.42 g/mol. Its IUPAC name is 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine.

Molecular Properties

• Compound Name: 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine
• PubChem CID: 155679567
• Molecular Formula: C20H18N8
• Molecular Weight: 370.42 g/mol
• Exact Mass: 370.17
• IUPAC Name: 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine
• SMILES: Nc1nc2cc(-c3ccn[nH]3)ccc2c2cn(CCNc3ccccn3)nc12
• InChI: InChI=1S/C20H18N8/c21-20-19-15(12-28(27-19)10-9-23-18-3-1-2-7-22-18)14-5-4-13(11-17(14)25-20)16-6-8-24-26-16/h1-8,11-12H,9-10H2,(H2,21,25)(H,22,23)(H,24,26)
• InChIKey: RDXYOBCIOHDPAL-UHFFFAOYSA-N
• XLogP: 3.06
• TPSA: 110.33 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	370.42
LogP ≤ 5	3.06
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine (CID 155679567) is 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine.

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

The canonical SMILES for 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine is Nc1nc2cc(-c3ccn[nH]3)ccc2c2cn(CCNc3ccccn3)nc12.

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

The InChIKey is RDXYOBCIOHDPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N8/c21-20-19-15(12-28(27-19)10-9-23-18-3-1-2-7-22-18)14-5-4-13(11-17(14)25-20)16-6-8-24-26-16/h1-8,11-12H,9-10H2,(H2,21,25)(H,22,23)(H,24,26).

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

7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine has a molecular weight of 370.42 g/mol, XLogP of 3.06, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(1H-pyrazol-5-yl)-2-[2-(pyridin-2-ylamino)ethyl]pyrazolo[3,4-c]quinolin-4-amine is sourced from PubChem (CID 155679567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).