3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine

C19H18N6 — CID 148865897

About 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine

3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine (PubChem CID 148865897) has the molecular formula C19H18N6 and a molecular weight of 330.40 g/mol. Its IUPAC name is 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine.

Molecular Properties

• Compound Name: 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine
• PubChem CID: 148865897
• Molecular Formula: C19H18N6
• Molecular Weight: 330.40 g/mol
• Exact Mass: 330.16
• IUPAC Name: 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine
• SMILES: NCCCc1cccc(-c2n[nH]c3cnc(-c4cccnc4)cc23)n1
• InChI: InChI=1S/C19H18N6/c20-8-2-6-14-5-1-7-16(23-14)19-15-10-17(13-4-3-9-21-11-13)22-12-18(15)24-25-19/h1,3-5,7,9-12H,2,6,8,20H2,(H,24,25)
• InChIKey: PAFHODWMYZVGIM-UHFFFAOYSA-N
• XLogP: 2.97
• TPSA: 93.37 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	330.40
LogP ≤ 5	2.97
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine?

The IUPAC name of 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine (CID 148865897) is 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine.

What is the SMILES notation for 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine?

The canonical SMILES for 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine is NCCCc1cccc(-c2n[nH]c3cnc(-c4cccnc4)cc23)n1.

What is the InChIKey of 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine?

The InChIKey is PAFHODWMYZVGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6/c20-8-2-6-14-5-1-7-16(23-14)19-15-10-17(13-4-3-9-21-11-13)22-12-18(15)24-25-19/h1,3-5,7,9-12H,2,6,8,20H2,(H,24,25).

What are the key properties of 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine?

3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine has a molecular weight of 330.40 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[6-(5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridin-3-yl)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 148865897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).