N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine

C75H51N3 — CID 163530919

IUPACN-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
SMILES[2H]c1c([2H])c(N(c2ccccc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c([2H])c([2H])c1-c1cccc2c(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cccc12
InChIInChI=1S/C75H51N3/c1-5-23-55(24-6-1)75(56-25-7-2-8-26-56)70-36-17-15-31-65(70)66-47-45-62(51-71(66)75)76(57-27-9-3-10-28-57)59-42-40-53(41-43-59)63-33-19-35-67-64(63)34-20-38-72(67)77(60-44-39-52-21-13-14-22-54(52)49-60)61-46-48-74-69(50-61)68-32-16-18-37-73(68)78(74)58-29-11-4-12-30-58/h1-51H/i40D,41D,42D,43D
InChIKeyBZSDFRVPAWSAPI-WNAPAYAFSA-N
MW998.28 g/mol
LogP20.06
Rot. Bonds10

About N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine

N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine (PubChem CID 163530919) has the molecular formula C75H51N3 and a molecular weight of 998.28 g/mol. Its IUPAC name is N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
PubChem CID163530919
Molecular FormulaC75H51N3
Molecular Weight998.28 g/mol
Exact Mass997.43
IUPAC NameN-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
SMILES[2H]c1c([2H])c(N(c2ccccc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c([2H])c([2H])c1-c1cccc2c(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cccc12
InChIInChI=1S/C75H51N3/c1-5-23-55(24-6-1)75(56-25-7-2-8-26-56)70-36-17-15-31-65(70)66-47-45-62(51-71(66)75)76(57-27-9-3-10-28-57)59-42-40-53(41-43-59)63-33-19-35-67-64(63)34-20-38-72(67)77(60-44-39-52-21-13-14-22-54(52)49-60)61-46-48-74-69(50-61)68-32-16-18-37-73(68)78(74)58-29-11-4-12-30-58/h1-51H/i40D,41D,42D,43D
InChIKeyBZSDFRVPAWSAPI-WNAPAYAFSA-N
XLogP20.06
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500998.28
LogP ≤ 520.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(9,9-diphenylfluoren-2-yl)-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-naphthalen-2-ylanilino)phenyl]naphthalen-1-yl]carbazol-3-amine
CID 163462319
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine;N-(9,9-diphenylfluoren-2-yl)-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine;9-phenyl-N-(2-phenylphenyl)-N-[5-[2,3,5,6-tetradeuterio-4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine;9-phenyl-N-(4-phenylphenyl)-N-[5-[2,3,5,6-tetradeuterio-4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
CID 163482556
9-phenyl-N-(2-phenylphenyl)-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine
CID 163530922
9,9-diphenyl-N-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylnaphthalen-1-yl)fluoren-2-amine;9,9-diphenyl-N-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(6-phenylnaphthalen-2-yl)fluoren-2-amine;9,9-diphenyl-N-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 161384283
N,9-diphenyl-N-[6-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-2-yl]carbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-[6-[2,3,5,6-tetradeuterio-4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]naphthalen-2-yl]carbazol-2-amine;9-phenyl-N-(2-phenylphenyl)-N-[6-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-2-yl]carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[6-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-2-yl]carbazol-2-amine
CID 163578353
N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylnaphthalen-1-yl)fluoren-2-amine;N-[4-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-naphthalen-1-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 158886069
9-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-N-[6-[2,3,5,6-tetradeuterio-4-(N-naphthalen-1-ylanilino)phenyl]naphthalen-2-yl]carbazol-2-amine
CID 163502975
9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(6-phenylnaphthalen-2-yl)fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 160503630
N-(9,9-diphenylfluoren-2-yl)-N-naphthalen-2-yl-2,9-diphenylcarbazol-3-amine
CID 165155346
N-naphthalen-2-yl-9,9-diphenyl-N-[9-phenyl-9-(9-phenylcarbazol-3-yl)fluoren-2-yl]fluoren-2-amine
CID 134452960
N-[4-[4-[3-[4-[3-[(9,9-diphenylfluoren-2-yl)-naphthalen-1-ylamino]phenyl]phenyl]carbazol-9-yl]phenyl]phenyl]-9,9-diphenyl-N-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 146576508
9,9-diphenyl-N-(4-phenylnaphthalen-1-yl)-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;9,9-diphenyl-N-(6-phenylnaphthalen-2-yl)-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine;N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-N-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 159373859

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine?
The IUPAC name of N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine (CID 163530919) is N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine.
What is the SMILES notation for N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine?
The canonical SMILES for N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine is [2H]c1c([2H])c(N(c2ccccc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c([2H])c([2H])c1-c1cccc2c(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cccc12.
What is the InChIKey of N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine?
The InChIKey is BZSDFRVPAWSAPI-WNAPAYAFSA-N. The full InChI is InChI=1S/C75H51N3/c1-5-23-55(24-6-1)75(56-25-7-2-8-26-56)70-36-17-15-31-65(70)66-47-45-62(51-71(66)75)76(57-27-9-3-10-28-57)59-42-40-53(41-43-59)63-33-19-35-67-64(63)34-20-38-72(67)77(60-44-39-52-21-13-14-22-54(52)49-60)61-46-48-74-69(50-61)68-32-16-18-37-73(68)78(74)58-29-11-4-12-30-58/h1-51H/i40D,41D,42D,43D.
What are the key properties of N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine?
N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine has a molecular weight of 998.28 g/mol, XLogP of 20.06, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-9-phenyl-N-[5-[2,3,5,6-tetradeuterio-4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]carbazol-3-amine is sourced from PubChem (CID 163530919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).