8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene

C92H72N2 — CID 90330350

About 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene

8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene (PubChem CID 90330350) has the molecular formula C92H72N2 and a molecular weight of 1205.60 g/mol. Its IUPAC name is 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene.

Molecular Properties

• Compound Name: 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene
• PubChem CID: 90330350
• Molecular Formula: C92H72N2
• Molecular Weight: 1205.60 g/mol
• Exact Mass: 1204.57
• IUPAC Name: 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene
• SMILES: CC1(C)c2cc(-c3ccccc3)ccc2N2c3ccc(-c4ccccc4)cc3C(C)(C)c3cc(-c4ccc(-c5ccc(-c6cc7c8c(c6)C(C)(C)c6cc(-c9ccc%10ccccc%10c9)ccc6N8c6ccc(-c8ccc9ccccc9c8)cc6C7(C)C)cc5)cc4)cc1c32
• InChI: InChI=1S/C92H72N2/c1-89(2)75-49-69(57-19-11-9-12-20-57)39-43-83(75)93-84-44-40-70(58-21-13-10-14-22-58)50-76(84)90(3,4)80-54-73(53-79(89)87(80)93)63-31-27-61(28-32-63)62-29-33-64(34-30-62)74-55-81-88-82(56-74)92(7,8)78-52-72(68-38-36-60-24-16-18-26-66(60)48-68)42-46-86(78)94(88)85-45-41-71(51-77(85)91(81,5)6)67-37-35-59-23-15-17-25-65(59)47-67/h9-56H,1-8H3
• InChIKey: ISWAVULDVAVWHH-UHFFFAOYSA-N
• XLogP: 25.16
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 7
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1205.60
LogP ≤ 5	25.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene?

The IUPAC name of 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene (CID 90330350) is 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene.

What is the SMILES notation for 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene?

The canonical SMILES for 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene is CC1(C)c2cc(-c3ccccc3)ccc2N2c3ccc(-c4ccccc4)cc3C(C)(C)c3cc(-c4ccc(-c5ccc(-c6cc7c8c(c6)C(C)(C)c6cc(-c9ccc%10ccccc%10c9)ccc6N8c6ccc(-c8ccc9ccccc9c8)cc6C7(C)C)cc5)cc4)cc1c32.

What is the InChIKey of 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene?

The InChIKey is ISWAVULDVAVWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C92H72N2/c1-89(2)75-49-69(57-19-11-9-12-20-57)39-43-83(75)93-84-44-40-70(58-21-13-10-14-22-58)50-76(84)90(3,4)80-54-73(53-79(89)87(80)93)63-31-27-61(28-32-63)62-29-33-64(34-30-62)74-55-81-88-82(56-74)92(7,8)78-52-72(68-38-36-60-24-16-18-26-66(60)48-68)42-46-86(78)94(88)85-45-41-71(51-77(85)91(81,5)6)67-37-35-59-23-15-17-25-65(59)47-67/h9-56H,1-8H3.

What are the key properties of 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene?

8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene has a molecular weight of 1205.60 g/mol, XLogP of 25.16, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 8,8,14,14-tetramethyl-5,17-dinaphthalen-2-yl-11-[4-[4-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene is sourced from PubChem (CID 90330350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).