3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole

C30H23N3 — CID 140902282

IUPAC3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
SMILESCc1cc(-c2ccccc2)c2[nH]c3c(-c4cccc(-c5ccccn5)n4)cc(C)cc3c2c1
InChIInChI=1S/C30H23N3/c1-19-15-22(21-9-4-3-5-10-21)29-23(16-19)24-17-20(2)18-25(30(24)33-29)26-12-8-13-28(32-26)27-11-6-7-14-31-27/h3-18,33H,1-2H3
InChIKeyZDWNINQMUBHBFB-UHFFFAOYSA-N
MW425.54 g/mol
LogP7.73
Rot. Bonds3

About 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole

3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole (PubChem CID 140902282) has the molecular formula C30H23N3 and a molecular weight of 425.54 g/mol. Its IUPAC name is 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole.

Molecular Properties

Compound Name3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
PubChem CID140902282
Molecular FormulaC30H23N3
Molecular Weight425.54 g/mol
Exact Mass425.19
IUPAC Name3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
SMILESCc1cc(-c2ccccc2)c2[nH]c3c(-c4cccc(-c5ccccn5)n4)cc(C)cc3c2c1
InChIInChI=1S/C30H23N3/c1-19-15-22(21-9-4-3-5-10-21)29-23(16-19)24-17-20(2)18-25(30(24)33-29)26-12-8-13-28(32-26)27-11-6-7-14-31-27/h3-18,33H,1-2H3
InChIKeyZDWNINQMUBHBFB-UHFFFAOYSA-N
XLogP7.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.54
LogP ≤ 57.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-ditert-butyl-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
CID 140902252
3,6-difluoro-1-(6-phenyl-2-pyridinyl)-8-pyridin-2-yl-9H-carbazole
CID 140902302
1-pyridin-2-yl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole
CID 164788747
2,4-dimethyl-6-(6-pyridin-2-yl-2-pyridinyl)phenol
CID 137254307
4,12-ditert-butyl-22-phenyl-8,29,30,31-tetrazaheptacyclo[23.3.1.115,19.120,24.02,7.06,10.09,14]hentriaconta-1(29),2,4,6,9,11,13,15(31),16,18,20(30),21,23,25,27-pentadecaene
CID 140932974
1-[4-phenyl-6-(3-phenylphenyl)-2-pyridinyl]-8-pyridin-2-yl-9H-carbazole
CID 140902230
2-[2,5-diphenyl-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-[2,5-diphenyl-4-(6-pyridin-2-yl-2-pyridinyl)phenyl]-6-pyridin-2-ylpyridine;2-[3-methyl-5-(trifluoromethyl)phenyl]-6-[4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]-2,5-diphenylphenyl]pyridine
CID 91363564
4-phenyl-2-[6-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-6-pyridin-2-ylpyridine
CID 15788654
2-[2-(2-phenylphenyl)-6-(6-pyridin-2-yl-2-pyridinyl)phenyl]-6-pyridin-2-ylpyridine
CID 141341209
iridium(3+);2-phenyl-6-pyridin-2-ylpyridine
CID 159332179
2-phenyl-6-pyridin-2-ylpyridine;platinum(2+)
CID 161405876
2-(4-methyl-2-phenylphenyl)pyridine
CID 20606677

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole?
The IUPAC name of 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole (CID 140902282) is 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole.
What is the SMILES notation for 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole?
The canonical SMILES for 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole is Cc1cc(-c2ccccc2)c2[nH]c3c(-c4cccc(-c5ccccn5)n4)cc(C)cc3c2c1.
What is the InChIKey of 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole?
The InChIKey is ZDWNINQMUBHBFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N3/c1-19-15-22(21-9-4-3-5-10-21)29-23(16-19)24-17-20(2)18-25(30(24)33-29)26-12-8-13-28(32-26)27-11-6-7-14-31-27/h3-18,33H,1-2H3.
What are the key properties of 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole?
3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole has a molecular weight of 425.54 g/mol, XLogP of 7.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-1-phenyl-8-(6-pyridin-2-yl-2-pyridinyl)-9H-carbazole is sourced from PubChem (CID 140902282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).