9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole

C46H37N3 — CID 146209484

IUPAC9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole
SMILESCC1(C)c2ccc(-n3c4ccccc4c4ccccc43)cc2C(C)(C)c2ccc(-c3cc(-c4cccnc4)cc(-c4cccnc4)c3)cc21
InChIInChI=1S/C46H37N3/c1-45(2)40-20-18-36(49-43-15-7-5-13-37(43)38-14-6-8-16-44(38)49)27-42(40)46(3,4)39-19-17-30(26-41(39)45)33-23-34(31-11-9-21-47-28-31)25-35(24-33)32-12-10-22-48-29-32/h5-29H,1-4H3
InChIKeyYLEITAJEFNFGSG-UHFFFAOYSA-N
MW631.82 g/mol
LogP11.54
Rot. Bonds4

About 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole

9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole (PubChem CID 146209484) has the molecular formula C46H37N3 and a molecular weight of 631.82 g/mol. Its IUPAC name is 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole.

Molecular Properties

Compound Name9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole
PubChem CID146209484
Molecular FormulaC46H37N3
Molecular Weight631.82 g/mol
Exact Mass631.30
IUPAC Name9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole
SMILESCC1(C)c2ccc(-n3c4ccccc4c4ccccc43)cc2C(C)(C)c2ccc(-c3cc(-c4cccnc4)cc(-c4cccnc4)c3)cc21
InChIInChI=1S/C46H37N3/c1-45(2)40-20-18-36(49-43-15-7-5-13-37(43)38-14-6-8-16-44(38)49)27-42(40)46(3,4)39-19-17-30(26-41(39)45)33-23-34(31-11-9-21-47-28-31)25-35(24-33)32-12-10-22-48-29-32/h5-29H,1-4H3
InChIKeyYLEITAJEFNFGSG-UHFFFAOYSA-N
XLogP11.54
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500631.82
LogP ≤ 511.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-carbazol-9-yl-9-(3-pyridin-3-ylphenyl)carbazole
CID 126749641
3,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-3-ylphenyl)carbazole
CID 160711176
3-pyridin-3-yl-9-[4-[4-[4-(2,2,3,3-tetramethylindol-1-yl)phenyl]phenyl]phenyl]carbazole
CID 90215679
N-(9,9-dimethyl-7-pyridin-3-ylfluoren-2-yl)-9-phenylcarbazol-3-amine
CID 71248522
9-[3-(3-pyridin-3-ylphenyl)-9,9'-spirobi[xanthene]-3'-yl]pyrido[3,4-b]indole
CID 118698541
3-pyridin-3-yl-9-(8-pyridin-3-yldibenzofuran-2-yl)carbazole
CID 163439035
N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-N-(4-pyridin-3-ylphenyl)-4-[3-[9-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-yl]phenyl]aniline
CID 158025945
9-(2,6-dipyridin-3-yl-4-pyridinyl)carbazole
CID 135264911
6-[2,6-bis(9,9-dimethylacridin-10-yl)carbazol-9-yl]-11-(3-pyridin-3-ylphenyl)phenanthro[9,10-b]pyrazine
CID 118912206
9-(2-pyridin-3-yl-4-pyridinyl)carbazole
CID 171768043
3-[9-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[7-(2,6-diphenyl-4-pyridinyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[4-[2-phenyl-6-(4-phenylphenyl)-4-pyridinyl]phenyl]carbazole
CID 159697484
N-[3-[3-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;3-[3-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-N-phenyl-N-(4-pyridin-3-ylphenyl)aniline;N-[3-[3-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]phenyl]-N,3,5-triphenylaniline
CID 160810129

Frequently Asked Questions

What is the IUPAC name of 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole?
The IUPAC name of 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole (CID 146209484) is 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole.
What is the SMILES notation for 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole?
The canonical SMILES for 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole is CC1(C)c2ccc(-n3c4ccccc4c4ccccc43)cc2C(C)(C)c2ccc(-c3cc(-c4cccnc4)cc(-c4cccnc4)c3)cc21.
What is the InChIKey of 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole?
The InChIKey is YLEITAJEFNFGSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H37N3/c1-45(2)40-20-18-36(49-43-15-7-5-13-37(43)38-14-6-8-16-44(38)49)27-42(40)46(3,4)39-19-17-30(26-41(39)45)33-23-34(31-11-9-21-47-28-31)25-35(24-33)32-12-10-22-48-29-32/h5-29H,1-4H3.
What are the key properties of 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole?
9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole has a molecular weight of 631.82 g/mol, XLogP of 11.54, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-(3,5-dipyridin-3-ylphenyl)-9,9,10,10-tetramethylanthracen-2-yl]carbazole is sourced from PubChem (CID 146209484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).