12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene

C216H128N8 — CID 158868113

About 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene

12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene (PubChem CID 158868113) has the molecular formula C216H128N8 and a molecular weight of 2835.46 g/mol. Its IUPAC name is 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene.

Molecular Properties

• Compound Name: 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
• PubChem CID: 158868113
• Molecular Formula: C216H128N8
• Molecular Weight: 2835.46 g/mol
• Exact Mass: 2833.03
• IUPAC Name: 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
• SMILES: c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8c9ccccc9ccc8c8ccc9ccccc9c87)ccc65)cc4)cc-2c13.c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8cc9ccccc9cc8c8cc9ccccc9cc87)ccc65)cc4)cc-2c13.c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8ccc9ccccc9c8c8c9ccccc9ccc87)ccc65)cc4)cc-2c13.c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8ccc9ccccc9c8c8ccc9ccccc9c87)ccc65)cc4)cc-2c13
• InChI: InChI=1S/4C54H32N2/c1-3-13-40-34(10-1)23-28-51-53(40)46-27-22-35-11-2-4-14-41(35)54(46)56(51)39-26-29-50-47(32-39)44-17-7-8-19-49(44)55(50)38-24-20-33(21-25-38)37-30-36-12-9-18-45-42-15-5-6-16-43(42)48(31-37)52(36)45;1-3-13-40-34(10-1)22-27-50-53(40)54-41-14-4-2-11-35(41)23-28-51(54)56(50)39-26-29-49-46(32-39)44-17-7-8-19-48(44)55(49)38-24-20-33(21-25-38)37-30-36-12-9-18-45-42-15-5-6-16-43(42)47(31-37)52(36)45;1-3-13-40-34(10-1)22-27-46-47-28-23-35-11-2-4-14-41(35)54(47)56(53(40)46)39-26-29-51-48(32-39)44-17-7-8-19-50(44)55(51)38-24-20-33(21-25-38)37-30-36-12-9-18-45-42-15-5-6-16-43(42)49(31-37)52(36)45;1-3-12-36-30-52-46(27-34(36)10-1)47-28-35-11-2-4-13-37(35)31-53(47)56(52)41-24-25-51-48(32-41)44-17-7-8-19-50(44)55(51)40-22-20-33(21-23-40)39-26-38-14-9-18-45-42-15-5-6-16-43(42)49(29-39)54(38)45/h4*1-32H
• InChIKey: JBMTYRZOBMUWNN-UHFFFAOYSA-N
• XLogP: 58.62
• TPSA: 39.44 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 12
• Heavy Atoms: 224
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2835.46
LogP ≤ 5	58.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene?

The IUPAC name of 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene (CID 158868113) is 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene.

What is the SMILES notation for 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene?

The canonical SMILES for 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene is c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8c9ccccc9ccc8c8ccc9ccccc9c87)ccc65)cc4)cc-2c13.c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8cc9ccccc9cc8c8cc9ccccc9cc87)ccc65)cc4)cc-2c13.c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8ccc9ccccc9c8c8c9ccccc9ccc87)ccc65)cc4)cc-2c13.c1ccc2c(c1)-c1cccc3cc(-c4ccc(-n5c6ccccc6c6cc(-n7c8ccc9ccccc9c8c8ccc9ccccc9c87)ccc65)cc4)cc-2c13.

What is the InChIKey of 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene?

The InChIKey is JBMTYRZOBMUWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C54H32N2/c1-3-13-40-34(10-1)23-28-51-53(40)46-27-22-35-11-2-4-14-41(35)54(46)56(51)39-26-29-50-47(32-39)44-17-7-8-19-49(44)55(50)38-24-20-33(21-25-38)37-30-36-12-9-18-45-42-15-5-6-16-43(42)48(31-37)52(36)45;1-3-13-40-34(10-1)22-27-50-53(40)54-41-14-4-2-11-35(41)23-28-51(54)56(50)39-26-29-49-46(32-39)44-17-7-8-19-48(44)55(49)38-24-20-33(21-25-38)37-30-36-12-9-18-45-42-15-5-6-16-43(42)47(31-37)52(36)45;1-3-13-40-34(10-1)22-27-46-47-28-23-35-11-2-4-14-41(35)54(47)56(53(40)46)39-26-29-51-48(32-39)44-17-7-8-19-50(44)55(51)38-24-20-33(21-25-38)37-30-36-12-9-18-45-42-15-5-6-16-43(42)49(31-37)52(36)45;1-3-12-36-30-52-46(27-34(36)10-1)47-28-35-11-2-4-13-37(35)31-53(47)56(52)41-24-25-51-48(32-41)44-17-7-8-19-50(44)55(51)40-22-20-33(21-23-40)39-26-38-14-9-18-45-42-15-5-6-16-43(42)49(29-39)54(38)45/h4*1-32H.

What are the key properties of 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene?

12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene has a molecular weight of 2835.46 g/mol, XLogP of 58.62, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene is sourced from PubChem (CID 158868113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).