5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine

C23H21N7 — CID 137116565

IUPAC5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
SMILESc1cc(-c2cncc3[nH]c(-c4n[nH]c5cnc(C6CCNCC6)cc45)cc23)ccn1
InChIInChI=1S/C23H21N7/c1-5-24-6-2-14(1)18-11-26-12-21-16(18)9-20(28-21)23-17-10-19(15-3-7-25-8-4-15)27-13-22(17)29-30-23/h1-2,5-6,9-13,15,25,28H,3-4,7-8H2,(H,29,30)
InChIKeyLFZWNUWTBMSYMB-UHFFFAOYSA-N
MW395.47 g/mol
LogP4.03
Rot. Bonds3

About 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine

5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine (PubChem CID 137116565) has the molecular formula C23H21N7 and a molecular weight of 395.47 g/mol. Its IUPAC name is 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
PubChem CID137116565
Molecular FormulaC23H21N7
Molecular Weight395.47 g/mol
Exact Mass395.19
IUPAC Name5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
SMILESc1cc(-c2cncc3[nH]c(-c4n[nH]c5cnc(C6CCNCC6)cc45)cc23)ccn1
InChIInChI=1S/C23H21N7/c1-5-24-6-2-14(1)18-11-26-12-21-16(18)9-20(28-21)23-17-10-19(15-3-7-25-8-4-15)27-13-22(17)29-30-23/h1-2,5-6,9-13,15,25,28H,3-4,7-8H2,(H,29,30)
InChIKeyLFZWNUWTBMSYMB-UHFFFAOYSA-N
XLogP4.03
TPSA95.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.47
LogP ≤ 54.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-[4-(furan-3-yl)-1H-pyrrolo[2,3-c]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
CID 137115850
5-(1-methylpyrazol-4-yl)-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137116608
3-[4-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
CID 137111429
3-[4-(5-fluorothiophen-2-yl)-1H-pyrrolo[3,2-c]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
CID 137280608
5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137112600
3-[4-(4-methylimidazol-1-yl)-1H-pyrrolo[3,2-c]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
CID 137110908
5-pyrazin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137112680
2-[5-(1-methylpyrazol-4-yl)-1H-indazol-3-yl]-4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridine
CID 137117159
3-fluoro-5-[2-(5-piperidin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-1H-pyrrolo[2,3-c]pyridin-4-yl]phenol
CID 137112491
3-fluoro-5-[2-[5-(5-piperidin-4-yloxy-3-pyridinyl)-1H-pyrazolo[3,4-c]pyridin-3-yl]-1H-pyrrolo[2,3-c]pyridin-4-yl]phenol
CID 137115860
3-[7-(5-fluorothiophen-2-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
CID 136947317
N-(4-methylpent-1-en-2-yl)-5-[3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-amine
CID 137033265

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine (CID 137116565) is 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine is c1cc(-c2cncc3[nH]c(-c4n[nH]c5cnc(C6CCNCC6)cc45)cc23)ccn1.
What is the InChIKey of 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is LFZWNUWTBMSYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N7/c1-5-24-6-2-14(1)18-11-26-12-21-16(18)9-20(28-21)23-17-10-19(15-3-7-25-8-4-15)27-13-22(17)29-30-23/h1-2,5-6,9-13,15,25,28H,3-4,7-8H2,(H,29,30).
What are the key properties of 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine?
5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 395.47 g/mol, XLogP of 4.03, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-4-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 137116565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).