9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine

C159H108N6 — CID 158160932

IUPAC9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine
SMILES[2H]c1c([2H])c([2H])c2c(C3(c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].[2H]c1c([2H])c([2H])c2c(C3(c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].[2H]c1c([2H])c([2H])c2c(C3(c4cccc5c4c4ccccc4n5-c4ccccc4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H]
InChIInChI=1S/3C53H36N2/c1-4-20-38(21-5-1)54(39-22-6-2-7-23-39)41-34-35-48-45(36-41)43-27-12-14-29-47(43)53(48,46-30-16-19-37-18-10-11-26-42(37)46)49-31-17-33-51-52(49)44-28-13-15-32-50(44)55(51)40-24-8-3-9-25-40;1-4-19-39(20-5-1)54(40-21-6-2-7-22-40)42-32-33-50-46(36-42)44-26-12-14-28-49(44)53(50,48-29-16-18-37-17-10-11-25-43(37)48)38-31-34-52-47(35-38)45-27-13-15-30-51(45)55(52)41-23-8-3-9-24-41;1-4-19-39(20-5-1)54(40-21-6-2-7-22-40)42-32-34-50-47(36-42)44-26-12-14-28-49(44)53(50,48-29-16-18-37-17-10-11-25-43(37)48)38-31-33-46-45-27-13-15-30-51(45)55(52(46)35-38)41-23-8-3-9-24-41/h3*1-36H/i10D,11D,16D,18D,19D,26D,30D;2*10D,11D,16D,17D,18D,25D,29D
InChIKeyFWGMGFOONDKGHQ-AFNAKLNYSA-N
MW2123.78 g/mol
LogP41.31
Rot. Bonds18

About 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine

9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine (PubChem CID 158160932) has the molecular formula C159H108N6 and a molecular weight of 2123.78 g/mol. Its IUPAC name is 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine.

Molecular Properties

Compound Name9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine
PubChem CID158160932
Molecular FormulaC159H108N6
Molecular Weight2123.78 g/mol
Exact Mass2122.00
IUPAC Name9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine
SMILES[2H]c1c([2H])c([2H])c2c(C3(c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].[2H]c1c([2H])c([2H])c2c(C3(c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].[2H]c1c([2H])c([2H])c2c(C3(c4cccc5c4c4ccccc4n5-c4ccccc4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H]
InChIInChI=1S/3C53H36N2/c1-4-20-38(21-5-1)54(39-22-6-2-7-23-39)41-34-35-48-45(36-41)43-27-12-14-29-47(43)53(48,46-30-16-19-37-18-10-11-26-42(37)46)49-31-17-33-51-52(49)44-28-13-15-32-50(44)55(51)40-24-8-3-9-25-40;1-4-19-39(20-5-1)54(40-21-6-2-7-22-40)42-32-33-50-46(36-42)44-26-12-14-28-49(44)53(50,48-29-16-18-37-17-10-11-25-43(37)48)38-31-34-52-47(35-38)45-27-13-15-30-51(45)55(52)41-23-8-3-9-24-41;1-4-19-39(20-5-1)54(40-21-6-2-7-22-40)42-32-34-50-47(36-42)44-26-12-14-28-49(44)53(50,48-29-16-18-37-17-10-11-25-43(37)48)38-31-33-46-45-27-13-15-30-51(45)55(52(46)35-38)41-23-8-3-9-24-41/h3*1-36H/i10D,11D,16D,18D,19D,26D,30D;2*10D,11D,16D,17D,18D,25D,29D
InChIKeyFWGMGFOONDKGHQ-AFNAKLNYSA-N
XLogP41.31
TPSA24.51 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms165
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002123.78
LogP ≤ 541.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine with MolForge

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Related Compounds

9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-3-N,3-N,6-N,6-N-tetraphenyl-9-(9-phenylcarbazol-2-yl)fluorene-3,6-diamine;9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-3-N,3-N,6-N,6-N-tetraphenyl-9-(9-phenylcarbazol-3-yl)fluorene-3,6-diamine;9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-3-N,3-N,6-N,6-N-tetraphenyl-9-(9-phenylcarbazol-4-yl)fluorene-3,6-diamine
CID 159405582
9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-2-yl)-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-3-yl)-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-4-yl)-3-N-(2-phenylphenyl)fluorene-3,6-diamine
CID 161152279
9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-4-yl)-3-N-(2-phenylphenyl)fluorene-3,6-diamine
CID 156687529
9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-9-(9-methylcarbazol-2-yl)-3-N-naphthalen-2-yl-3-N,6-N,6-N-triphenylfluorene-3,6-diamine;9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-3-N-naphthalen-2-yl-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-1-yl)fluorene-3,6-diamine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-3-N,3-N,6-N,6-N-tetraphenyl-9-(9-phenylcarbazol-4-yl)fluorene-3,6-diamine
CID 160657368
9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-3-N-naphthalen-2-yl-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-1-yl)fluorene-3,6-diamine
CID 156687625
9-(2,3,4,5,6-pentadeuteriophenyl)-N-phenyl-9-(9-phenylcarbazol-1-yl)-N-(2-phenylphenyl)fluoren-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-phenyl-9-(9-phenylcarbazol-2-yl)-N-(2-phenylphenyl)fluoren-3-amine;9-(2,3,4,5,6-pentadeuteriophenyl)-N-phenyl-9-(9-phenylcarbazol-3-yl)-N-(2-phenylphenyl)fluoren-3-amine
CID 161188876
N,9-diphenyl-N-(9,9'-spirobi[fluorene]-3-yl)carbazol-3-amine
CID 126538335
3-N-naphthalen-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-1-yl)fluorene-3,6-diamine;3-N-naphthalen-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-2-yl)fluorene-3,6-diamine;3-N-naphthalen-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-4-yl)fluorene-3,6-diamine
CID 159437763
9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-N-naphthalen-1-yl-N-phenyl-9-(9-phenylcarbazol-1-yl)fluoren-3-amine;9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-N-naphthalen-1-yl-N-phenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-N-naphthalen-2-yl-N-phenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine
CID 157266640
9-phenyl-N-(9-phenylcarbazol-2-yl)-N-(9,9'-spirobi[fluorene]-3-yl)carbazol-2-amine
CID 145334998
9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-3-N-naphthalen-1-yl-3-N,6-N,6-N-triphenyl-9-(9-phenylcarbazol-3-yl)fluorene-3,6-diamine
CID 156687394
N,9-diphenyl-N-(1',2',3',4'-tetradeuteriospiro[benzo[a]phenalene-7,9'-fluorene]-4-yl)carbazol-3-amine
CID 165019267

Frequently Asked Questions

What is the IUPAC name of 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine?
The IUPAC name of 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine (CID 158160932) is 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine.
What is the SMILES notation for 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine?
The canonical SMILES for 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine is [2H]c1c([2H])c([2H])c2c(C3(c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].[2H]c1c([2H])c([2H])c2c(C3(c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].[2H]c1c([2H])c([2H])c2c(C3(c4cccc5c4c4ccccc4n5-c4ccccc4)c4ccccc4-c4cc(N(c5ccccc5)c5ccccc5)ccc43)c([2H])c([2H])c([2H])c2c1[2H].
What is the InChIKey of 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine?
The InChIKey is FWGMGFOONDKGHQ-AFNAKLNYSA-N. The full InChI is InChI=1S/3C53H36N2/c1-4-20-38(21-5-1)54(39-22-6-2-7-23-39)41-34-35-48-45(36-41)43-27-12-14-29-47(43)53(48,46-30-16-19-37-18-10-11-26-42(37)46)49-31-17-33-51-52(49)44-28-13-15-32-50(44)55(51)40-24-8-3-9-25-40;1-4-19-39(20-5-1)54(40-21-6-2-7-22-40)42-32-33-50-46(36-42)44-26-12-14-28-49(44)53(50,48-29-16-18-37-17-10-11-25-43(37)48)38-31-34-52-47(35-38)45-27-13-15-30-51(45)55(52)41-23-8-3-9-24-41;1-4-19-39(20-5-1)54(40-21-6-2-7-22-40)42-32-34-50-47(36-42)44-26-12-14-28-49(44)53(50,48-29-16-18-37-17-10-11-25-43(37)48)38-31-33-46-45-27-13-15-30-51(45)55(52(46)35-38)41-23-8-3-9-24-41/h3*1-36H/i10D,11D,16D,18D,19D,26D,30D;2*10D,11D,16D,17D,18D,25D,29D.
What are the key properties of 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine?
9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine has a molecular weight of 2123.78 g/mol, XLogP of 41.31, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-2-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-3-yl)fluoren-3-amine;9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N,N-diphenyl-9-(9-phenylcarbazol-4-yl)fluoren-3-amine is sourced from PubChem (CID 158160932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).