6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole

C32H24N4 — CID 121322463

IUPAC6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole
SMILESCC1(C)C=Cc2c1ccc1c2c2ccccc2n1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C32H24N4/c1-32(2)20-19-23-25(32)17-18-27-28(23)24-15-9-10-16-26(24)36(27)31-34-29(21-11-5-3-6-12-21)33-30(35-31)22-13-7-4-8-14-22/h3-20H,1-2H3
InChIKeyRKGCMJUBYIWRCX-UHFFFAOYSA-N
MW464.57 g/mol
LogP7.61
Rot. Bonds3

About 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole

6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole (PubChem CID 121322463) has the molecular formula C32H24N4 and a molecular weight of 464.57 g/mol. Its IUPAC name is 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole.

Molecular Properties

Compound Name6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole
PubChem CID121322463
Molecular FormulaC32H24N4
Molecular Weight464.57 g/mol
Exact Mass464.20
IUPAC Name6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole
SMILESCC1(C)C=Cc2c1ccc1c2c2ccccc2n1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C32H24N4/c1-32(2)20-19-23-25(32)17-18-27-28(23)24-15-9-10-16-26(24)36(27)31-34-29(21-11-5-3-6-12-21)33-30(35-31)22-13-7-4-8-14-22/h3-20H,1-2H3
InChIKeyRKGCMJUBYIWRCX-UHFFFAOYSA-N
XLogP7.61
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.57
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-(4,6-diphenyl-1,3,5-triazin-2-yl)-9',9'-dimethylspiro[9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene-14,10'-anthracene]
CID 163786674
7-[4-(1,1,2,2,3,3-hexamethyl-6-phenylinden-5-yl)-6-phenyl-1,3,5-triazin-2-yl]benzo[c]carbazole
CID 170567748
9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 140937273
5,12-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole sulfide
CID 158568390
9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)-14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 126580373
9-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]-14-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 167267776
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-14-pyridin-2-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 166563611
14,14-dimethyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-14,14-dimethyl-5-phenyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 157165823
9-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-[9-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]carbazol-4-yl]carbazole
CID 176871191
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-14-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 169037238
9-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-14-(3-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 156554565
14-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,9-diphenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 155153308

Frequently Asked Questions

What is the IUPAC name of 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole?
The IUPAC name of 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole (CID 121322463) is 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole.
What is the SMILES notation for 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole?
The canonical SMILES for 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole is CC1(C)C=Cc2c1ccc1c2c2ccccc2n1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole?
The InChIKey is RKGCMJUBYIWRCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24N4/c1-32(2)20-19-23-25(32)17-18-27-28(23)24-15-9-10-16-26(24)36(27)31-34-29(21-11-5-3-6-12-21)33-30(35-31)22-13-7-4-8-14-22/h3-20H,1-2H3.
What are the key properties of 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole?
6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole has a molecular weight of 464.57 g/mol, XLogP of 7.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,3-dimethylcyclopenta[c]carbazole is sourced from PubChem (CID 121322463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).