6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine

C69H57N3 — CID 88952063

IUPAC6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine
SMILESCC1c2c(n(-c3ccccc3)c3ccc(N(c4ccc5c(c4)C(C)(C)C4=CCCC=C45)c4ccc5ccccc5c4)cc23)C=CC1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2ccccc2c1
InChIInChI=1S/C69H57N3/c1-44-64(71(51-30-28-46-18-10-12-20-48(46)40-51)54-32-35-58-56-24-14-16-26-61(56)69(4,5)63(58)43-54)37-38-66-67(44)59-41-52(33-36-65(59)72(66)49-21-7-6-8-22-49)70(50-29-27-45-17-9-11-19-47(45)39-50)53-31-34-57-55-23-13-15-25-60(55)68(2,3)62(57)42-53/h6-12,14,16-44,64H,13,15H2,1-5H3
InChIKeyXEXMECNHTNITIP-UHFFFAOYSA-N
MW928.24 g/mol
LogP18.44
Rot. Bonds7

About 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine

6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine (PubChem CID 88952063) has the molecular formula C69H57N3 and a molecular weight of 928.24 g/mol. Its IUPAC name is 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine.

Molecular Properties

Compound Name6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine
PubChem CID88952063
Molecular FormulaC69H57N3
Molecular Weight928.24 g/mol
Exact Mass927.46
IUPAC Name6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine
SMILESCC1c2c(n(-c3ccccc3)c3ccc(N(c4ccc5c(c4)C(C)(C)C4=CCCC=C45)c4ccc5ccccc5c4)cc23)C=CC1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2ccccc2c1
InChIInChI=1S/C69H57N3/c1-44-64(71(51-30-28-46-18-10-12-20-48(46)40-51)54-32-35-58-56-24-14-16-26-61(56)69(4,5)63(58)43-54)37-38-66-67(44)59-41-52(33-36-65(59)72(66)49-21-7-6-8-22-49)70(50-29-27-45-17-9-11-19-47(45)39-50)53-31-34-57-55-23-13-15-25-60(55)68(2,3)62(57)42-53/h6-12,14,16-44,64H,13,15H2,1-5H3
InChIKeyXEXMECNHTNITIP-UHFFFAOYSA-N
XLogP18.44
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500928.24
LogP ≤ 518.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine with MolForge

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Related Compounds

N-anthracen-2-yl-N-(9,9-diphenylfluoren-2-yl)-5-methyl-9-phenyl-5,6-dihydrocarbazol-3-amine
CID 88891816
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(3,9,9-trimethyl-2,3-dihydrofluoren-2-yl)carbazol-3-amine
CID 166698349
N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 58969347
N-[4-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)-6,7-dihydrofluoren-3-amine
CID 154935189
N-[4-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 118289290
17-N-(9,9-dimethyl-2,3-dihydrofluoren-2-yl)-5-N-(9,9-dimethylfluoren-2-yl)-8,8,14,14-tetramethyl-5-N,17-N-dinaphthalen-2-yl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9(21),10,15,17,19-octaene-5,17-diamine
CID 89065270
9-cyclohexa-1,5-dien-1-yl-N-(9-phenylcarbazol-3-yl)-N-(7,9,9-trimethyl-6,7-dihydrofluoren-2-yl)carbazol-3-amine
CID 144619497
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 161470218
N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-2-yl-2,9-diphenylcarbazol-3-amine
CID 165155424
9,9-dimethyl-N-naphthalen-2-yl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 129085046
N-[3-[3-(N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)anilino)-5-methylphenyl]-5-methylphenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 71021422
N-(9,9-dimethyl-7,8-dihydrofluoren-2-yl)-9,9-dimethyl-N-[4-(9-phenyl-3,4-dihydrocarbazol-3-yl)phenyl]fluoren-2-amine
CID 155484122

Frequently Asked Questions

What is the IUPAC name of 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine?
The IUPAC name of 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine (CID 88952063) is 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine.
What is the SMILES notation for 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine?
The canonical SMILES for 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine is CC1c2c(n(-c3ccccc3)c3ccc(N(c4ccc5c(c4)C(C)(C)C4=CCCC=C45)c4ccc5ccccc5c4)cc23)C=CC1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2ccccc2c1.
What is the InChIKey of 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine?
The InChIKey is XEXMECNHTNITIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H57N3/c1-44-64(71(51-30-28-46-18-10-12-20-48(46)40-51)54-32-35-58-56-24-14-16-26-61(56)69(4,5)63(58)43-54)37-38-66-67(44)59-41-52(33-36-65(59)72(66)49-21-7-6-8-22-49)70(50-29-27-45-17-9-11-19-47(45)39-50)53-31-34-57-55-23-13-15-25-60(55)68(2,3)62(57)42-53/h6-12,14,16-44,64H,13,15H2,1-5H3.
What are the key properties of 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine?
6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine has a molecular weight of 928.24 g/mol, XLogP of 18.44, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(9,9-dimethyl-6,7-dihydrofluoren-2-yl)-3-N-(9,9-dimethylfluoren-2-yl)-4-methyl-3-N,6-N-dinaphthalen-2-yl-9-phenyl-3,4-dihydrocarbazole-3,6-diamine is sourced from PubChem (CID 88952063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).