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

C195H135N9 — CID 159437763

IUPAC3-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
SMILES[2H]c1c([2H])c([2H])c(C2(c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c3c3ccccc3n4-c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccc5ccccc5c4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c5ccccc5n(-c5ccccc5)c34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc32)c([2H])c1[2H]
InChIInChI=1S/3C65H45N3/c1-6-24-47(25-7-1)65(61-37-21-36-56-55-35-18-19-38-63(55)68(64(56)61)51-32-14-5-15-33-51)59-42-40-52(66(48-26-8-2-9-27-48)49-28-10-3-11-29-49)44-57(59)58-45-53(41-43-60(58)65)67(50-30-12-4-13-31-50)62-39-20-23-46-22-16-17-34-54(46)62;1-6-23-47(24-7-1)65(48-37-40-57-56-34-18-19-35-63(56)68(64(57)43-48)52-31-14-5-15-32-52)60-41-38-53(66(49-25-8-2-9-26-49)50-27-10-3-11-28-50)44-58(60)59-45-54(39-42-61(59)65)67(51-29-12-4-13-30-51)62-36-20-22-46-21-16-17-33-55(46)62;1-6-23-48(24-7-1)65(61-34-20-36-63-64(61)56-33-18-19-35-62(56)68(63)52-31-14-5-15-32-52)59-41-39-54(66(49-25-8-2-9-26-49)50-27-10-3-11-28-50)44-57(59)58-45-55(40-42-60(58)65)67(51-29-12-4-13-30-51)53-38-37-46-21-16-17-22-47(46)43-53/h3*1-45H/i1D,6D,7D,24D,25D;2*1D,6D,7D,23D,24D
InChIKeyLRUFIFULLFCJIQ-QZDDGGDRSA-N
MW2619.38 g/mol
LogP51.72
Rot. Bonds27

About 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

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 (PubChem CID 159437763) has the molecular formula C195H135N9 and a molecular weight of 2619.38 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name3-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
PubChem CID159437763
Molecular FormulaC195H135N9
Molecular Weight2619.38 g/mol
Exact Mass2617.18
IUPAC Name3-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
SMILES[2H]c1c([2H])c([2H])c(C2(c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c3c3ccccc3n4-c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccc5ccccc5c4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c5ccccc5n(-c5ccccc5)c34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc32)c([2H])c1[2H]
InChIInChI=1S/3C65H45N3/c1-6-24-47(25-7-1)65(61-37-21-36-56-55-35-18-19-38-63(55)68(64(56)61)51-32-14-5-15-33-51)59-42-40-52(66(48-26-8-2-9-27-48)49-28-10-3-11-29-49)44-57(59)58-45-53(41-43-60(58)65)67(50-30-12-4-13-31-50)62-39-20-23-46-22-16-17-34-54(46)62;1-6-23-47(24-7-1)65(48-37-40-57-56-34-18-19-35-63(56)68(64(57)43-48)52-31-14-5-15-32-52)60-41-38-53(66(49-25-8-2-9-26-49)50-27-10-3-11-28-50)44-58(60)59-45-54(39-42-61(59)65)67(51-29-12-4-13-30-51)62-36-20-22-46-21-16-17-33-55(46)62;1-6-23-48(24-7-1)65(61-34-20-36-63-64(61)56-33-18-19-35-62(56)68(63)52-31-14-5-15-32-52)59-41-39-54(66(49-25-8-2-9-26-49)50-27-10-3-11-28-50)44-57(59)58-45-55(40-42-60(58)65)67(51-29-12-4-13-30-51)53-38-37-46-21-16-17-22-47(46)43-53/h3*1-45H/i1D,6D,7D,24D,25D;2*1D,6D,7D,23D,24D
InChIKeyLRUFIFULLFCJIQ-QZDDGGDRSA-N
XLogP51.72
TPSA34.23 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds27
Heavy Atoms204
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002619.38
LogP ≤ 551.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 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 with MolForge

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Related Compounds

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-(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-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
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-(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-(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
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
9-(1,3,4,5,6,7,8-heptadeuterionaphthalen-2-yl)-3-N,3-N,6-N,6-N-tetraphenyl-9-(9-phenylcarbazol-1-yl)fluorene-3,6-diamine
CID 156687417
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
N-naphthalen-1-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-naphthalen-2-ylanilino)phenyl]naphthalen-1-yl]carbazol-2-amine
CID 163903614
N-naphthalen-1-yl-9-phenyl-N-[2,3,5,6-tetradeuterio-4-[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]phenyl]carbazol-2-amine
CID 163499652

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is [2H]c1c([2H])c([2H])c(C2(c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c3c3ccccc3n4-c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccc5ccccc5c4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c5ccccc5n(-c5ccccc5)c34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc32)c([2H])c1[2H].
What is the InChIKey of 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?
The InChIKey is LRUFIFULLFCJIQ-QZDDGGDRSA-N. The full InChI is InChI=1S/3C65H45N3/c1-6-24-47(25-7-1)65(61-37-21-36-56-55-35-18-19-38-63(55)68(64(56)61)51-32-14-5-15-33-51)59-42-40-52(66(48-26-8-2-9-27-48)49-28-10-3-11-29-49)44-57(59)58-45-53(41-43-60(58)65)67(50-30-12-4-13-31-50)62-39-20-23-46-22-16-17-34-54(46)62;1-6-23-47(24-7-1)65(48-37-40-57-56-34-18-19-35-63(56)68(64(57)43-48)52-31-14-5-15-32-52)60-41-38-53(66(49-25-8-2-9-26-49)50-27-10-3-11-28-50)44-58(60)59-45-54(39-42-61(59)65)67(51-29-12-4-13-30-51)62-36-20-22-46-21-16-17-33-55(46)62;1-6-23-48(24-7-1)65(61-34-20-36-63-64(61)56-33-18-19-35-62(56)68(63)52-31-14-5-15-32-52)59-41-39-54(66(49-25-8-2-9-26-49)50-27-10-3-11-28-50)44-57(59)58-45-55(40-42-60(58)65)67(51-29-12-4-13-30-51)53-38-37-46-21-16-17-22-47(46)43-53/h3*1-45H/i1D,6D,7D,24D,25D;2*1D,6D,7D,23D,24D.
What are the key properties of 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?
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 has a molecular weight of 2619.38 g/mol, XLogP of 51.72, 27 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159437763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).