3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine

C23H15N7 — CID 137114642

IUPAC3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
SMILESc1cncc(-c2cccc3[nH]c(-c4n[nH]c5ccc(-c6cncnc6)nc45)cc23)c1
InChIInChI=1S/C23H15N7/c1-4-16(14-3-2-8-24-10-14)17-9-21(27-19(17)5-1)23-22-20(29-30-23)7-6-18(28-22)15-11-25-13-26-12-15/h1-13,27H,(H,29,30)
InChIKeySNPKQWNHTSRGOW-UHFFFAOYSA-N
MW389.42 g/mol
LogP4.63
Rot. Bonds3

About 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine

3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine (PubChem CID 137114642) has the molecular formula C23H15N7 and a molecular weight of 389.42 g/mol. Its IUPAC name is 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
PubChem CID137114642
Molecular FormulaC23H15N7
Molecular Weight389.42 g/mol
Exact Mass389.14
IUPAC Name3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
SMILESc1cncc(-c2cccc3[nH]c(-c4n[nH]c5ccc(-c6cncnc6)nc45)cc23)c1
InChIInChI=1S/C23H15N7/c1-4-16(14-3-2-8-24-10-14)17-9-21(27-19(17)5-1)23-22-20(29-30-23)7-6-18(28-22)15-11-25-13-26-12-15/h1-13,27H,(H,29,30)
InChIKeySNPKQWNHTSRGOW-UHFFFAOYSA-N
XLogP4.63
TPSA96.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.42
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
The IUPAC name of 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine (CID 137114642) is 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
The canonical SMILES for 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine is c1cncc(-c2cccc3[nH]c(-c4n[nH]c5ccc(-c6cncnc6)nc45)cc23)c1.
What is the InChIKey of 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
The InChIKey is SNPKQWNHTSRGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N7/c1-4-16(14-3-2-8-24-10-14)17-9-21(27-19(17)5-1)23-22-20(29-30-23)7-6-18(28-22)15-11-25-13-26-12-15/h1-13,27H,(H,29,30).
What are the key properties of 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine has a molecular weight of 389.42 g/mol, XLogP of 4.63, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 137114642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).