7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine

C51H38N2 — CID 58569033

IUPAC7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
SMILESC=Cc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-n5c6ccccc6c6ccccc65)ccc3-4)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C51H38N2/c1-4-34-20-22-35(23-21-34)36-24-26-38(27-25-36)52(48-19-11-13-37-12-5-6-14-41(37)48)39-28-30-42-43-31-29-40(33-47(43)51(2,3)46(42)32-39)53-49-17-9-7-15-44(49)45-16-8-10-18-50(45)53/h4-33H,1H2,2-3H3
InChIKeyDVFLNHLNSIZEAL-UHFFFAOYSA-N
MW678.88 g/mol
LogP14.02
Rot. Bonds6

About 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine

7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine (PubChem CID 58569033) has the molecular formula C51H38N2 and a molecular weight of 678.88 g/mol. Its IUPAC name is 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine.

Molecular Properties

Compound Name7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
PubChem CID58569033
Molecular FormulaC51H38N2
Molecular Weight678.88 g/mol
Exact Mass678.30
IUPAC Name7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
SMILESC=Cc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-n5c6ccccc6c6ccccc65)ccc3-4)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C51H38N2/c1-4-34-20-22-35(23-21-34)36-24-26-38(27-25-36)52(48-19-11-13-37-12-5-6-14-41(37)48)39-28-30-42-43-31-29-40(33-47(43)51(2,3)46(42)32-39)53-49-17-9-7-15-44(49)45-16-8-10-18-50(45)53/h4-33H,1H2,2-3H3
InChIKeyDVFLNHLNSIZEAL-UHFFFAOYSA-N
XLogP14.02
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500678.88
LogP ≤ 514.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-N-[4-[4-[(9,9-dimethylfluoren-2-yl)-[9-(4-ethenylphenyl)carbazol-3-yl]amino]phenyl]phenyl]-9-(4-ethenylphenyl)carbazol-3-amine;9-(4-ethenylphenyl)-N-[4-[4-[[9-(4-ethenylphenyl)carbazol-3-yl]-naphthalen-1-ylamino]phenyl]phenyl]-N-naphthalen-1-ylcarbazol-3-amine;9-(4-ethenylphenyl)-N-[4-[4-(N-[9-(4-ethenylphenyl)carbazol-3-yl]-4-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)carbazol-3-amine;methane
CID 157074747
7-carbazol-9-yl-9,9-dimethyl-N-naphthalen-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
CID 71038303
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-yl-7-(9-phenylcarbazol-3-yl)fluoren-2-amine
CID 138710344
N,4-bis(4-carbazol-9-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N,N-bis(4-carbazol-9-ylphenyl)-4-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;7-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(4-carbazol-9-ylphenyl)-4-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]aniline;N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine;N-phenyl-4-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]aniline
CID 162097788
7-carbazol-9-yl-N-(9,9-dimethylfluoren-2-yl)-9,9-bis[(4-ethenylphenyl)methyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 144690352
9,9-dimethyl-N-naphthalen-1-yl-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 71175461
9,9-dimethyl-N-naphthalen-1-yl-7-(9-phenylcarbazol-2-yl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;N-[9,9-dimethyl-7-(9-phenylcarbazol-2-yl)fluoren-2-yl]-9,9-dimethyl-N-naphthalen-1-yl-7-(9-phenylcarbazol-3-yl)fluoren-2-amine
CID 159946266
9,9-dimethyl-N-naphthalen-1-yl-7-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 71038321
9,9-dimethyl-N-naphthalen-1-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 162198244
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 161334482
2-N,7-N-bis(4-ethenylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;4-ethenyl-N-[4-[4-(N-(4-ethenylphenyl)anilino)phenyl]phenyl]-N-phenylaniline;N-[4-[4-(4-ethenyl-N-(3-methylphenyl)anilino)phenyl]phenyl]-3-methyl-N-phenylaniline;N-[4-[4-(4-ethenyl-N-naphthalen-1-ylanilino)phenyl]phenyl]-N-(4-ethenylphenyl)naphthalen-1-amine
CID 159874682
N-[4-[9-(9,9-dimethylfluoren-2-yl)-6-[4-(N-naphthalen-1-ylanilino)phenyl]carbazol-3-yl]phenyl]-N-phenylnaphthalen-1-amine
CID 137467185

Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
The IUPAC name of 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine (CID 58569033) is 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine.
What is the SMILES notation for 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
The canonical SMILES for 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine is C=Cc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-n5c6ccccc6c6ccccc65)ccc3-4)c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
The InChIKey is DVFLNHLNSIZEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H38N2/c1-4-34-20-22-35(23-21-34)36-24-26-38(27-25-36)52(48-19-11-13-37-12-5-6-14-41(37)48)39-28-30-42-43-31-29-40(33-47(43)51(2,3)46(42)32-39)53-49-17-9-7-15-44(49)45-16-8-10-18-50(45)53/h4-33H,1H2,2-3H3.
What are the key properties of 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine?
7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine has a molecular weight of 678.88 g/mol, XLogP of 14.02, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-carbazol-9-yl-N-[4-(4-ethenylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine is sourced from PubChem (CID 58569033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).