5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine

C23H16N6O — CID 137113192

About 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine

5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine (PubChem CID 137113192) has the molecular formula C23H16N6O and a molecular weight of 392.42 g/mol. Its IUPAC name is 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine.

Molecular Properties

• Compound Name: 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine
• PubChem CID: 137113192
• Molecular Formula: C23H16N6O
• Molecular Weight: 392.42 g/mol
• Exact Mass: 392.14
• IUPAC Name: 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine
• SMILES: Nc1cncc(-c2cc3c(-c4cc5c(-c6ccoc6)cccc5[nH]4)n[nH]c3cn2)c1
• InChI: InChI=1S/C23H16N6O/c24-15-6-14(9-25-10-15)20-8-18-22(11-26-20)28-29-23(18)21-7-17-16(13-4-5-30-12-13)2-1-3-19(17)27-21/h1-12,27H,24H2,(H,28,29)
• InChIKey: DKDAHGRXVSFGEQ-UHFFFAOYSA-N
• XLogP: 5.01
• TPSA: 109.41 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	392.42
LogP ≤ 5	5.01
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine (CID 137113192) is 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine.

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

The canonical SMILES for 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine is Nc1cncc(-c2cc3c(-c4cc5c(-c6ccoc6)cccc5[nH]4)n[nH]c3cn2)c1.

What is the InChIKey of 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine?

The InChIKey is DKDAHGRXVSFGEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N6O/c24-15-6-14(9-25-10-15)20-8-18-22(11-26-20)28-29-23(18)21-7-17-16(13-4-5-30-12-13)2-1-3-19(17)27-21/h1-12,27H,24H2,(H,28,29).

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

5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine has a molecular weight of 392.42 g/mol, XLogP of 5.01, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-[4-(furan-3-yl)-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine is sourced from PubChem (CID 137113192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).