3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine

C24H24N6 — CID 70225347

IUPAC3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1cc(N2CCNCC2)ncc1-c1cnc2[nH]cc(-c3ccc4c(c3)CCN4)c2c1
InChIInChI=1S/C24H24N6/c1-3-22-17(5-6-26-22)11-16(1)21-15-29-24-20(21)12-19(14-28-24)18-2-4-23(27-13-18)30-9-7-25-8-10-30/h1-4,11-15,25-26H,5-10H2,(H,28,29)
InChIKeyCBBGDZLNNRCFRB-UHFFFAOYSA-N
MW396.50 g/mol
LogP3.67
Rot. Bonds3

About 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine

3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 70225347) has the molecular formula C24H24N6 and a molecular weight of 396.50 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID70225347
Molecular FormulaC24H24N6
Molecular Weight396.50 g/mol
Exact Mass396.21
IUPAC Name3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1cc(N2CCNCC2)ncc1-c1cnc2[nH]cc(-c3ccc4c(c3)CCN4)c2c1
InChIInChI=1S/C24H24N6/c1-3-22-17(5-6-26-22)11-16(1)21-15-29-24-20(21)12-19(14-28-24)18-2-4-23(27-13-18)30-9-7-25-8-10-30/h1-4,11-15,25-26H,5-10H2,(H,28,29)
InChIKeyCBBGDZLNNRCFRB-UHFFFAOYSA-N
XLogP3.67
TPSA68.87 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.50
LogP ≤ 53.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine with MolForge

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Related Compounds

5-[3-(2,3-dihydro-1H-indol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]pyridin-2-amine
CID 70226179
3-[1-(2-phenylethyl)pyrazol-4-yl]-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
CID 90031175
3-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
CID 90031465
(4-methoxyphenyl)-[5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone
CID 172834628
3-ethynyl-5-(2-piperazin-1-yl-4-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
CID 160710902
5-(6-piperazin-1-yl-3-pyridinyl)-1,3-dihydroinden-2-one
CID 159120939
5-(6-piperazin-1-yl-3-pyridinyl)pyrimidin-2-amine
CID 141215033
1-[5-(4-fluorophenyl)-2-pyridinyl]piperazine;hydrochloride
CID 23133533
1-(5-pyridin-3-yl-2-pyridinyl)piperazine;hydrochloride
CID 23133526
3-[4-(2,3-difluorophenyl)-1,2,4-triazol-3-yl]-5-(6-pyrrolidin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
CID 135448256
2-[4-[5-[4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]-1,3-oxazole
CID 146274463
[3-(3-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]-piperazin-1-ylmethanone
CID 141325162

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine (CID 70225347) is 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine is c1cc(N2CCNCC2)ncc1-c1cnc2[nH]cc(-c3ccc4c(c3)CCN4)c2c1.
What is the InChIKey of 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is CBBGDZLNNRCFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6/c1-3-22-17(5-6-26-22)11-16(1)21-15-29-24-20(21)12-19(14-28-24)18-2-4-23(27-13-18)30-9-7-25-8-10-30/h1-4,11-15,25-26H,5-10H2,(H,28,29).
What are the key properties of 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 396.50 g/mol, XLogP of 3.67, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-indol-5-yl)-5-(6-piperazin-1-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 70225347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).