6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole

C34H22N6 — CID 123972055

IUPAC6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4c5ccn(-c6cccc(-c7cccnc7)n6)c5ccc43)n2)nc1
InChIInChI=1S/C34H22N6/c1-2-13-30-24(9-1)34-25-18-21-39(32-14-5-11-26(37-32)23-8-7-19-35-22-23)29(25)16-17-31(34)40(30)33-15-6-12-28(38-33)27-10-3-4-20-36-27/h1-22H
InChIKeyFTSZRUQCIHCZCQ-UHFFFAOYSA-N
MW514.59 g/mol
LogP7.64
Rot. Bonds4

About 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole

6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole (PubChem CID 123972055) has the molecular formula C34H22N6 and a molecular weight of 514.59 g/mol. Its IUPAC name is 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole.

Molecular Properties

Compound Name6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole
PubChem CID123972055
Molecular FormulaC34H22N6
Molecular Weight514.59 g/mol
Exact Mass514.19
IUPAC Name6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4c5ccn(-c6cccc(-c7cccnc7)n6)c5ccc43)n2)nc1
InChIInChI=1S/C34H22N6/c1-2-13-30-24(9-1)34-25-18-21-39(32-14-5-11-26(37-32)23-8-7-19-35-22-23)29(25)16-17-31(34)40(30)33-15-6-12-28(38-33)27-10-3-4-20-36-27/h1-22H
InChIKeyFTSZRUQCIHCZCQ-UHFFFAOYSA-N
XLogP7.64
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.59
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole?
The IUPAC name of 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole (CID 123972055) is 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole.
What is the SMILES notation for 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole?
The canonical SMILES for 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4c5ccn(-c6cccc(-c7cccnc7)n6)c5ccc43)n2)nc1.
What is the InChIKey of 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole?
The InChIKey is FTSZRUQCIHCZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N6/c1-2-13-30-24(9-1)34-25-18-21-39(32-14-5-11-26(37-32)23-8-7-19-35-22-23)29(25)16-17-31(34)40(30)33-15-6-12-28(38-33)27-10-3-4-20-36-27/h1-22H.
What are the key properties of 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole?
6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole has a molecular weight of 514.59 g/mol, XLogP of 7.64, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-pyridin-2-yl-2-pyridinyl)-3-(6-pyridin-3-yl-2-pyridinyl)pyrrolo[2,3-c]carbazole is sourced from PubChem (CID 123972055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).