9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole

C34H22N4 — CID 59449580

IUPAC9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2)cn1
InChIInChI=1S/C34H22N4/c1-5-13-29-25(9-1)26-10-2-6-14-30(26)37(29)33-19-17-23(21-35-33)24-18-20-34(36-22-24)38-31-15-7-3-11-27(31)28-12-4-8-16-32(28)38/h1-22H
InChIKeyKRYVAVACLLIVOD-UHFFFAOYSA-N
MW486.58 g/mol
LogP8.34
Rot. Bonds3

About 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole

9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole (PubChem CID 59449580) has the molecular formula C34H22N4 and a molecular weight of 486.58 g/mol. Its IUPAC name is 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole.

Molecular Properties

Compound Name9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole
PubChem CID59449580
Molecular FormulaC34H22N4
Molecular Weight486.58 g/mol
Exact Mass486.18
IUPAC Name9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2)cn1
InChIInChI=1S/C34H22N4/c1-5-13-29-25(9-1)26-10-2-6-14-30(26)37(29)33-19-17-23(21-35-33)24-18-20-34(36-22-24)38-31-15-7-3-11-27(31)28-12-4-8-16-32(28)38/h1-22H
InChIKeyKRYVAVACLLIVOD-UHFFFAOYSA-N
XLogP8.34
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.58
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole?
The IUPAC name of 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole (CID 59449580) is 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole.
What is the SMILES notation for 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole?
The canonical SMILES for 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole is c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2)cn1.
What is the InChIKey of 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole?
The InChIKey is KRYVAVACLLIVOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N4/c1-5-13-29-25(9-1)26-10-2-6-14-30(26)37(29)33-19-17-23(21-35-33)24-18-20-34(36-22-24)38-31-15-7-3-11-27(31)28-12-4-8-16-32(28)38/h1-22H.
What are the key properties of 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole?
9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole has a molecular weight of 486.58 g/mol, XLogP of 8.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[5-(6-carbazol-9-yl-3-pyridinyl)-2-pyridinyl]carbazole is sourced from PubChem (CID 59449580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).