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

C39H25N5 — CID 118041251

IUPAC9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
SMILESc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)n2)nc(-c2cccc(-n3c4ccccc4c4ccccc43)n2)c1
InChIInChI=1S/C39H25N5/c1-5-20-34-26(12-1)27-13-2-6-21-35(27)43(34)38-24-10-18-32(41-38)30-16-9-17-31(40-30)33-19-11-25-39(42-33)44-36-22-7-3-14-28(36)29-15-4-8-23-37(29)44/h1-25H
InChIKeyQMDOHQYQNFSPGO-UHFFFAOYSA-N
MW563.66 g/mol
LogP9.40
Rot. Bonds4

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

9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole (PubChem CID 118041251) has the molecular formula C39H25N5 and a molecular weight of 563.66 g/mol. Its IUPAC name is 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole.

Molecular Properties

Compound Name9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
PubChem CID118041251
Molecular FormulaC39H25N5
Molecular Weight563.66 g/mol
Exact Mass563.21
IUPAC Name9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
SMILESc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)n2)nc(-c2cccc(-n3c4ccccc4c4ccccc43)n2)c1
InChIInChI=1S/C39H25N5/c1-5-20-34-26(12-1)27-13-2-6-21-35(27)43(34)38-24-10-18-32(41-38)30-16-9-17-31(40-30)33-19-11-25-39(42-33)44-36-22-7-3-14-28(36)29-15-4-8-23-37(29)44/h1-25H
InChIKeyQMDOHQYQNFSPGO-UHFFFAOYSA-N
XLogP9.40
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.66
LogP ≤ 59.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

12-(6-carbazol-9-yl-2-pyridinyl)-11-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]indolo[2,3-a]carbazole
CID 58038308
9-[6-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-phenyl-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]carbazole
CID 138513651
5-[6-(6-pyrido[4,3-b]indol-5-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole
CID 59480507
9-[6-(6-pyrido[3,4-b]indol-9-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,4-b]indole
CID 59480497
5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
CID 58570110
9-[4-carbazol-9-yl-6-(6-carbazol-9-yl-2-pyridinyl)-1,3,5-triazin-2-yl]carbazole
CID 165047384
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
CID 165167552
9-[6-[2-[4-(6-carbazol-9-yl-2-pyridinyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]-2-pyridinyl]carbazole
CID 59500751
5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
CID 58038356
N-[bis[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]phosphoryl]-N-phenylaniline
CID 58518389
9-[6-[4-carbazol-9-yl-6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-3-phenylcarbazole
CID 165167529
9-[6-[6-(4-phenylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole
CID 59480347

Frequently Asked Questions

What is the IUPAC name of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
The IUPAC name of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole (CID 118041251) is 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole.
What is the SMILES notation for 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
The canonical SMILES for 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole is c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)n2)nc(-c2cccc(-n3c4ccccc4c4ccccc43)n2)c1.
What is the InChIKey of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
The InChIKey is QMDOHQYQNFSPGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H25N5/c1-5-20-34-26(12-1)27-13-2-6-21-35(27)43(34)38-24-10-18-32(41-38)30-16-9-17-31(40-30)33-19-11-25-39(42-33)44-36-22-7-3-14-28(36)29-15-4-8-23-37(29)44/h1-25H.
What are the key properties of 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole?
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole has a molecular weight of 563.66 g/mol, XLogP of 9.40, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole is sourced from PubChem (CID 118041251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).