1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone

C25H24N6O2 — CID 66760699

About 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone

1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone (PubChem CID 66760699) has the molecular formula C25H24N6O2 and a molecular weight of 440.51 g/mol. Its IUPAC name is 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone.

Molecular Properties

• Compound Name: 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone
• PubChem CID: 66760699
• Molecular Formula: C25H24N6O2
• Molecular Weight: 440.51 g/mol
• Exact Mass: 440.20
• IUPAC Name: 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone
• SMILES: CC(=O)N1CCC(n2cc(-c3cnc(N)c4oc(-c5ccc6[nH]ccc6c5)cc34)cn2)CC1
• InChI: InChI=1S/C25H24N6O2/c1-15(32)30-8-5-19(6-9-30)31-14-18(12-29-31)21-13-28-25(26)24-20(21)11-23(33-24)17-2-3-22-16(10-17)4-7-27-22/h2-4,7,10-14,19,27H,5-6,8-9H2,1H3,(H2,26,28)
• InChIKey: UYKKWPYCJJATDN-UHFFFAOYSA-N
• XLogP: 4.61
• TPSA: 105.97 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	440.51
LogP ≤ 5	4.61
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone?

The IUPAC name of 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone (CID 66760699) is 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone.

What is the SMILES notation for 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone?

The canonical SMILES for 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone is CC(=O)N1CCC(n2cc(-c3cnc(N)c4oc(-c5ccc6[nH]ccc6c5)cc34)cn2)CC1.

What is the InChIKey of 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone?

The InChIKey is UYKKWPYCJJATDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O2/c1-15(32)30-8-5-19(6-9-30)31-14-18(12-29-31)21-13-28-25(26)24-20(21)11-23(33-24)17-2-3-22-16(10-17)4-7-27-22/h2-4,7,10-14,19,27H,5-6,8-9H2,1H3,(H2,26,28).

What are the key properties of 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone?

1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone has a molecular weight of 440.51 g/mol, XLogP of 4.61, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[4-[7-amino-2-(1H-indol-5-yl)furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone is sourced from PubChem (CID 66760699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).