9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole

C132H92N4O4 — CID 159024447

About 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole

9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole (PubChem CID 159024447) has the molecular formula C132H92N4O4 and a molecular weight of 1798.21 g/mol. Its IUPAC name is 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole.

Molecular Properties

• Compound Name: 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole
• PubChem CID: 159024447
• Molecular Formula: C132H92N4O4
• Molecular Weight: 1798.21 g/mol
• Exact Mass: 1796.71
• IUPAC Name: 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole
• SMILES: CC1(C)c2ccccc2-c2c1ccc1c2c2ccccc2n1-c1ccc2oc3ccccc3c2c1.CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3ccc4oc5ccccc5c4c3)c21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3cc21.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc2oc3ccccc3c2c1
• InChI: InChI=1S/4C33H23NO/c1-33(2)25-12-6-3-10-22(25)31-26(33)16-17-28-32(31)23-11-4-7-13-27(23)34(28)20-15-18-30-24(19-20)21-9-5-8-14-29(21)35-30;1-33(2)26-12-6-3-11-24(26)31-27(33)17-16-23-21-9-4-7-13-28(21)34(32(23)31)20-15-18-30-25(19-20)22-10-5-8-14-29(22)35-30;1-33(2)26-12-6-3-9-21(26)23-16-17-28-31(32(23)33)24-11-4-7-13-27(24)34(28)20-15-18-30-25(19-20)22-10-5-8-14-29(22)35-30;1-33(2)27-12-6-3-9-21(27)24-18-25-22-10-4-7-13-29(22)34(30(25)19-28(24)33)20-15-16-32-26(17-20)23-11-5-8-14-31(23)35-32/h4*3-19H,1-2H3
• InChIKey: JUCQDIYJLVVCMP-UHFFFAOYSA-N
• XLogP: 35.96
• TPSA: 72.28 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 4
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1798.21
LogP ≤ 5	35.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole?

The IUPAC name of 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole (CID 159024447) is 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole.

What is the SMILES notation for 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole?

The canonical SMILES for 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole is CC1(C)c2ccccc2-c2c1ccc1c2c2ccccc2n1-c1ccc2oc3ccccc3c2c1.CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3ccc4oc5ccccc5c4c3)c21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3cc21.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1ccc2oc3ccccc3c2c1.

What is the InChIKey of 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole?

The InChIKey is JUCQDIYJLVVCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/4C33H23NO/c1-33(2)25-12-6-3-10-22(25)31-26(33)16-17-28-32(31)23-11-4-7-13-27(23)34(28)20-15-18-30-24(19-20)21-9-5-8-14-29(21)35-30;1-33(2)26-12-6-3-11-24(26)31-27(33)17-16-23-21-9-4-7-13-28(21)34(32(23)31)20-15-18-30-25(19-20)22-10-5-8-14-29(22)35-30;1-33(2)26-12-6-3-9-21(26)23-16-17-28-31(32(23)33)24-11-4-7-13-27(24)34(28)20-15-18-30-25(19-20)22-10-5-8-14-29(22)35-30;1-33(2)27-12-6-3-9-21(27)24-18-25-22-10-4-7-13-29(22)34(30(25)19-28(24)33)20-15-16-32-26(17-20)23-11-5-8-14-31(23)35-32/h4*3-19H,1-2H3.

What are the key properties of 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole?

9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole has a molecular weight of 1798.21 g/mol, XLogP of 35.96, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 9-dibenzofuran-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;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole is sourced from PubChem (CID 159024447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).