4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole

C21H15N5 — CID 137112879

IUPAC4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole
SMILESc1cncc(-c2cc(-c3cc4c(-c5cccnc5)cccc4[nH]3)[nH]n2)c1
InChIInChI=1S/C21H15N5/c1-6-16(14-4-2-8-22-12-14)17-10-20(24-18(17)7-1)21-11-19(25-26-21)15-5-3-9-23-13-15/h1-13,24H,(H,25,26)
InChIKeyKCWTWNLDRFELDN-UHFFFAOYSA-N
MW337.39 g/mol
LogP4.68
Rot. Bonds3

About 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole

4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole (PubChem CID 137112879) has the molecular formula C21H15N5 and a molecular weight of 337.39 g/mol. Its IUPAC name is 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole.

Molecular Properties

Compound Name4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole
PubChem CID137112879
Molecular FormulaC21H15N5
Molecular Weight337.39 g/mol
Exact Mass337.13
IUPAC Name4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole
SMILESc1cncc(-c2cc(-c3cc4c(-c5cccnc5)cccc4[nH]3)[nH]n2)c1
InChIInChI=1S/C21H15N5/c1-6-16(14-4-2-8-22-12-14)17-10-20(24-18(17)7-1)21-11-19(25-26-21)15-5-3-9-23-13-15/h1-13,24H,(H,25,26)
InChIKeyKCWTWNLDRFELDN-UHFFFAOYSA-N
XLogP4.68
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-pyrrolo[3,2-c]pyridine
CID 137145048
3-(4-pyridin-3-yl-1H-indol-2-yl)-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137114642
5-(1H-pyrazol-4-yl)-3-(4-pyridin-3-yl-1H-indol-2-yl)-1H-indazole
CID 137115638
5-(5-methyl-3-pyridinyl)-3-(4-pyridin-3-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 145254746
5-[3-(4-pyridin-3-yl-1H-indol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-amine
CID 137040412
2-pyridin-3-yl-1H-indole-4-carboxamide
CID 22014956
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
4-pyridin-4-yl-2-[3-[5-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]-1H-pyrazol-5-yl]-1H-indole
CID 137114557
3-[5-[3-(3-pyridin-3-yl-1H-pyrazol-5-yl)phenyl]-1H-pyrazol-3-yl]pyridine;4-[3-[3-(5-pyridin-4-yl-1H-pyrazol-3-yl)phenyl]-1H-pyrazol-5-yl]pyridine
CID 144664737
N-[[5-[3-(4-pyridin-3-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 137113427
N-[5-[3-(4-pyridin-3-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]butanamide
CID 137113222
2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-imidazo[4,5-b]pyridine
CID 137042112

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole?
The IUPAC name of 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole (CID 137112879) is 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole.
What is the SMILES notation for 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole?
The canonical SMILES for 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole is c1cncc(-c2cc(-c3cc4c(-c5cccnc5)cccc4[nH]3)[nH]n2)c1.
What is the InChIKey of 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole?
The InChIKey is KCWTWNLDRFELDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N5/c1-6-16(14-4-2-8-22-12-14)17-10-20(24-18(17)7-1)21-11-19(25-26-21)15-5-3-9-23-13-15/h1-13,24H,(H,25,26).
What are the key properties of 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole?
4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole has a molecular weight of 337.39 g/mol, XLogP of 4.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-yl-2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-indole is sourced from PubChem (CID 137112879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).