5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine

C35H29N11 — CID 159717788

IUPAC5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1ccc(-c2nn3c(c2-c2c[nH]c4ncccc24)CCC3)nc1.c1ccc(-c2nn3c(c2-c2cnc4[nH]ncc4c2)CCC3)nc1
InChIInChI=1S/C18H15N5.C17H14N6/c1-2-8-19-14(6-1)17-16(15-7-4-10-23(15)22-17)13-11-21-18-12(13)5-3-9-20-18;1-2-6-18-13(4-1)16-15(14-5-3-7-23(14)22-16)11-8-12-10-20-21-17(12)19-9-11/h1-3,5-6,8-9,11H,4,7,10H2,(H,20,21);1-2,4,6,8-10H,3,5,7H2,(H,19,20,21)
InChIKeyMZQOMCWNZQDGPK-UHFFFAOYSA-N
MW603.69 g/mol
LogP6.26
Rot. Bonds4

About 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine

5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 159717788) has the molecular formula C35H29N11 and a molecular weight of 603.69 g/mol. Its IUPAC name is 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID159717788
Molecular FormulaC35H29N11
Molecular Weight603.69 g/mol
Exact Mass603.26
IUPAC Name5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1ccc(-c2nn3c(c2-c2c[nH]c4ncccc24)CCC3)nc1.c1ccc(-c2nn3c(c2-c2cnc4[nH]ncc4c2)CCC3)nc1
InChIInChI=1S/C18H15N5.C17H14N6/c1-2-8-19-14(6-1)17-16(15-7-4-10-23(15)22-17)13-11-21-18-12(13)5-3-9-20-18;1-2-6-18-13(4-1)16-15(14-5-3-7-23(14)22-16)11-8-12-10-20-21-17(12)19-9-11/h1-3,5-6,8-9,11H,4,7,10H2,(H,20,21);1-2,4,6,8-10H,3,5,7H2,(H,19,20,21)
InChIKeyMZQOMCWNZQDGPK-UHFFFAOYSA-N
XLogP6.26
TPSA131.67 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500603.69
LogP ≤ 56.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine (CID 159717788) is 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine is c1ccc(-c2nn3c(c2-c2c[nH]c4ncccc24)CCC3)nc1.c1ccc(-c2nn3c(c2-c2cnc4[nH]ncc4c2)CCC3)nc1.
What is the InChIKey of 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is MZQOMCWNZQDGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5.C17H14N6/c1-2-8-19-14(6-1)17-16(15-7-4-10-23(15)22-17)13-11-21-18-12(13)5-3-9-20-18;1-2-6-18-13(4-1)16-15(14-5-3-7-23(14)22-16)11-8-12-10-20-21-17(12)19-9-11/h1-3,5-6,8-9,11H,4,7,10H2,(H,20,21);1-2,4,6,8-10H,3,5,7H2,(H,19,20,21).
What are the key properties of 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine?
5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 603.69 g/mol, XLogP of 6.26, 4 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrazolo[3,4-b]pyridine;3-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 159717788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).