12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole

C126H94N10 — CID 159639259

IUPAC12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole
SMILESCC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cc(-c2ccccc2)nc(-c2ccccc2)c1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccnc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cncnc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1nc(-c2ccccc2)cc(-c2ccccc2)n1
InChIInChI=1S/C38H28N2.C37H27N3.C26H20N2.C25H19N3/c1-38(2)31-19-11-9-17-28(31)29-21-22-35-36(37(29)38)30-18-10-12-20-34(30)40(35)27-23-32(25-13-5-3-6-14-25)39-33(24-27)26-15-7-4-8-16-26;1-37(2)29-19-11-9-17-26(29)27-21-22-33-34(35(27)37)28-18-10-12-20-32(28)40(33)36-38-30(24-13-5-3-6-14-24)23-31(39-36)25-15-7-4-8-16-25;1-26(2)21-11-5-3-9-18(21)19-13-14-23-24(25(19)26)20-10-4-6-12-22(20)28(23)17-8-7-15-27-16-17;1-25(2)20-9-5-3-7-17(20)18-11-12-22-23(24(18)25)19-8-4-6-10-21(19)28(22)16-13-26-15-27-14-16/h3-24H,1-2H3;3-23H,1-2H3;3-16H,1-2H3;3-15H,1-2H3
InChIKeyMQDHKBQRJWQITL-UHFFFAOYSA-N
MW1748.21 g/mol
LogP31.40
Rot. Bonds8

About 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole

12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole (PubChem CID 159639259) has the molecular formula C126H94N10 and a molecular weight of 1748.21 g/mol. Its IUPAC name is 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole.

Molecular Properties

Compound Name12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole
PubChem CID159639259
Molecular FormulaC126H94N10
Molecular Weight1748.21 g/mol
Exact Mass1746.77
IUPAC Name12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole
SMILESCC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cc(-c2ccccc2)nc(-c2ccccc2)c1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccnc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cncnc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1nc(-c2ccccc2)cc(-c2ccccc2)n1
InChIInChI=1S/C38H28N2.C37H27N3.C26H20N2.C25H19N3/c1-38(2)31-19-11-9-17-28(31)29-21-22-35-36(37(29)38)30-18-10-12-20-34(30)40(35)27-23-32(25-13-5-3-6-14-25)39-33(24-27)26-15-7-4-8-16-26;1-37(2)29-19-11-9-17-26(29)27-21-22-33-34(35(27)37)28-18-10-12-20-32(28)40(33)36-38-30(24-13-5-3-6-14-24)23-31(39-36)25-15-7-4-8-16-25;1-26(2)21-11-5-3-9-18(21)19-13-14-23-24(25(19)26)20-10-4-6-12-22(20)28(23)17-8-7-15-27-16-17;1-25(2)20-9-5-3-7-17(20)18-11-12-22-23(24(18)25)19-8-4-6-10-21(19)28(22)16-13-26-15-27-14-16/h3-24H,1-2H3;3-23H,1-2H3;3-16H,1-2H3;3-15H,1-2H3
InChIKeyMQDHKBQRJWQITL-UHFFFAOYSA-N
XLogP31.40
TPSA97.06 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001748.21
LogP ≤ 531.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole with MolForge

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Related Compounds

5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole
CID 66805080
12,12-dimethyl-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indeno[1,2-c]carbazole
CID 169014734
5-[4-[3-(3,5-diphenylphenyl)phenyl]-6-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]pyrimidin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole
CID 134237091
5-[3-[2,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]pyrimidin-4-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole
CID 126630735
5-(2-dibenzofuran-4-yl-6-phenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole
CID 118153947
5-[2,6-bis(3-carbazol-9-ylphenyl)-4-(4,6-diphenylpyrimidin-2-yl)phenyl]-12,12-dimethylindeno[1,2-c]carbazole
CID 158364365
5-[3-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-[4,6-bis[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole
CID 158120881
5-[4-[2-(9,9-dimethylfluoren-2-yl)carbazol-9-yl]-6-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]-1,3,5-triazin-2-yl]-12,12-dimethylindeno[1,2-c]carbazole
CID 126632761
11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[1,2-c]carbazole;20-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-9,15,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaene
CID 159253282
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole
CID 58511641
5-(9,9-dimethylfluoren-2-yl)-12-(4,6-diphenylpyrimidin-2-yl)indolo[3,2-c]carbazole
CID 138649925
9-(4,6-diphenylpyrimidin-2-yl)-24,24-dimethyl-9-azahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene
CID 122464817

Frequently Asked Questions

What is the IUPAC name of 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole?
The IUPAC name of 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole (CID 159639259) is 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole.
What is the SMILES notation for 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole?
The canonical SMILES for 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole is CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cc(-c2ccccc2)nc(-c2ccccc2)c1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccnc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cncnc1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1nc(-c2ccccc2)cc(-c2ccccc2)n1.
What is the InChIKey of 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole?
The InChIKey is MQDHKBQRJWQITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H28N2.C37H27N3.C26H20N2.C25H19N3/c1-38(2)31-19-11-9-17-28(31)29-21-22-35-36(37(29)38)30-18-10-12-20-34(30)40(35)27-23-32(25-13-5-3-6-14-25)39-33(24-27)26-15-7-4-8-16-26;1-37(2)29-19-11-9-17-26(29)27-21-22-33-34(35(27)37)28-18-10-12-20-32(28)40(33)36-38-30(24-13-5-3-6-14-24)23-31(39-36)25-15-7-4-8-16-25;1-26(2)21-11-5-3-9-18(21)19-13-14-23-24(25(19)26)20-10-4-6-12-22(20)28(23)17-8-7-15-27-16-17;1-25(2)20-9-5-3-7-17(20)18-11-12-22-23(24(18)25)19-8-4-6-10-21(19)28(22)16-13-26-15-27-14-16/h3-24H,1-2H3;3-23H,1-2H3;3-16H,1-2H3;3-15H,1-2H3.
What are the key properties of 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole?
12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole has a molecular weight of 1748.21 g/mol, XLogP of 31.40, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 12,12-dimethyl-5-pyridin-3-ylindeno[1,2-c]carbazole;12,12-dimethyl-5-pyrimidin-5-ylindeno[1,2-c]carbazole;5-(2,6-diphenyl-4-pyridinyl)-12,12-dimethylindeno[1,2-c]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12,12-dimethylindeno[1,2-c]carbazole is sourced from PubChem (CID 159639259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).