2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole

C24H16N4 — CID 118145454

IUPAC2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole
SMILESc1ccc(-n2cc3cc4c5ccccc5n(-c5cccnc5)c4cc3n2)cc1
InChIInChI=1S/C24H16N4/c1-2-7-18(8-3-1)27-16-17-13-21-20-10-4-5-11-23(20)28(19-9-6-12-25-15-19)24(21)14-22(17)26-27/h1-16H
InChIKeyHTBBRQYAUSWPET-UHFFFAOYSA-N
MW360.42 g/mol
LogP5.52
Rot. Bonds2

About 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole

2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole (PubChem CID 118145454) has the molecular formula C24H16N4 and a molecular weight of 360.42 g/mol. Its IUPAC name is 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole.

Molecular Properties

Compound Name2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole
PubChem CID118145454
Molecular FormulaC24H16N4
Molecular Weight360.42 g/mol
Exact Mass360.14
IUPAC Name2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole
SMILESc1ccc(-n2cc3cc4c5ccccc5n(-c5cccnc5)c4cc3n2)cc1
InChIInChI=1S/C24H16N4/c1-2-7-18(8-3-1)27-16-17-13-21-20-10-4-5-11-23(20)28(19-9-6-12-25-15-19)24(21)14-22(17)26-27/h1-16H
InChIKeyHTBBRQYAUSWPET-UHFFFAOYSA-N
XLogP5.52
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.42
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-pyridin-3-ylbenzo[b]carbazole
CID 122464099
5-[3-(4-phenylphenyl)phenyl]-11-pyridin-3-ylindolo[3,2-b]carbazole
CID 140944253
14-phenyl-3-pyridin-3-yl-3,14-diazahexacyclo[11.11.0.02,10.04,9.015,24.017,22]tetracosa-1(13),2(10),4,6,8,11,15,17,19,21,23-undecaene
CID 122465006
3-iodo-9-pyridin-3-ylcarbazole
CID 156633056
5-pyridin-3-ylpyrido[3,2-b]indole
CID 59459758
22-pyridin-3-yl-12,22-diazahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 146555319
7-phenyl-9-(9-pyridin-3-ylcarbazol-3-yl)benzo[c]carbazole
CID 129294310
2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole
CID 118300806
5,6-dimethyl-2-phenylindazole
CID 135006746
9-phenylcarbazole;pyridine
CID 158880805
3,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-3-ylphenyl)carbazole
CID 160711176
5-methoxy-2-pyridin-3-ylindazole
CID 121320237

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole?
The IUPAC name of 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole (CID 118145454) is 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole.
What is the SMILES notation for 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole?
The canonical SMILES for 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole is c1ccc(-n2cc3cc4c5ccccc5n(-c5cccnc5)c4cc3n2)cc1.
What is the InChIKey of 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole?
The InChIKey is HTBBRQYAUSWPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N4/c1-2-7-18(8-3-1)27-16-17-13-21-20-10-4-5-11-23(20)28(19-9-6-12-25-15-19)24(21)14-22(17)26-27/h1-16H.
What are the key properties of 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole?
2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole has a molecular weight of 360.42 g/mol, XLogP of 5.52, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-9-pyridin-3-ylpyrazolo[3,4-b]carbazole is sourced from PubChem (CID 118145454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).