9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine

C159H118N6 — CID 167563853

About 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine

9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine (PubChem CID 167563853) has the molecular formula C159H118N6 and a molecular weight of 2151.97 g/mol. Its IUPAC name is 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine.

Molecular Properties

• Compound Name: 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine
• PubChem CID: 167563853
• Molecular Formula: C159H118N6
• Molecular Weight: 2151.97 g/mol
• Exact Mass: 2150.19
• IUPAC Name: 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine
• SMILES: [2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c(-c3c([2H])c([2H])c(N(c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)c([2H])c3[2H])c([2H])c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c(N(c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c3c([2H])c([2H])c4c(c3[2H])C(C)(C)c3c([2H])c([2H])c([2H])c([2H])c3-4)c([2H])c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c([2H])c1C2(C)C([2H])([2H])[2H]
• InChI: InChI=1S/C57H42N2.2C51H38N2/c1-57(2)53-22-11-9-20-49(53)50-34-33-48(38-54(50)57)58(46-31-28-42(29-32-46)41-26-24-40(25-27-41)39-14-5-3-6-15-39)47-19-13-16-43(36-47)44-30-35-56-52(37-44)51-21-10-12-23-55(51)59(56)45-17-7-4-8-18-45;2*1-51(2)47-22-11-9-20-43(47)44-30-29-42(34-48(44)51)52(40-27-24-36(25-28-40)35-14-5-3-6-15-35)41-19-13-16-37(32-41)38-26-31-50-46(33-38)45-21-10-12-23-49(45)53(50)39-17-7-4-8-18-39/h3-38H,1-2H3;2*3-34H,1-2H3/i3D,5D,6D,14D,15D,24D,25D,26D,27D,28D,29D,31D,32D;3D,5D,6D,9D,11D,14D,15D,20D,22D,24D,25D,27D,28D,29D,30D,34D;1D3,9D,11D,20D,22D,29D,30D,34D
• InChIKey: FAEJSKVQLZXLRA-BQXMLWELSA-N
• XLogP: 43.35
• TPSA: 24.51 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 20
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2151.97
LogP ≤ 5	43.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine?

The IUPAC name of 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine (CID 167563853) is 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine.

What is the SMILES notation for 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine?

The canonical SMILES for 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine is [2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c(-c3c([2H])c([2H])c(N(c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)c([2H])c3[2H])c([2H])c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c(N(c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c3c([2H])c([2H])c4c(c3[2H])C(C)(C)c3c([2H])c([2H])c([2H])c([2H])c3-4)c([2H])c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])-c1c([2H])c([2H])c(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c([2H])c1C2(C)C([2H])([2H])[2H].

What is the InChIKey of 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine?

The InChIKey is FAEJSKVQLZXLRA-BQXMLWELSA-N. The full InChI is InChI=1S/C57H42N2.2C51H38N2/c1-57(2)53-22-11-9-20-49(53)50-34-33-48(38-54(50)57)58(46-31-28-42(29-32-46)41-26-24-40(25-27-41)39-14-5-3-6-15-39)47-19-13-16-43(36-47)44-30-35-56-52(37-44)51-21-10-12-23-55(51)59(56)45-17-7-4-8-18-45;2*1-51(2)47-22-11-9-20-43(47)44-30-29-42(34-48(44)51)52(40-27-24-36(25-28-40)35-14-5-3-6-15-35)41-19-13-16-37(32-41)38-26-31-50-46(33-38)45-21-10-12-23-49(45)53(50)39-17-7-4-8-18-39/h3-38H,1-2H3;2*3-34H,1-2H3/i3D,5D,6D,14D,15D,24D,25D,26D,27D,28D,29D,31D,32D;3D,5D,6D,9D,11D,14D,15D,20D,22D,24D,25D,27D,28D,29D,30D,34D;1D3,9D,11D,20D,22D,29D,30D,34D.

What are the key properties of 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine?

9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine has a molecular weight of 2151.97 g/mol, XLogP of 43.35, 20 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9,9-dimethyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2,3,5,6-tetradeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]fluoren-2-amine;1,3,4,5,6,7,8-heptadeuterio-9-methyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9-(trideuteriomethyl)fluoren-2-amine is sourced from PubChem (CID 167563853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).