9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine

C58H48N2 — CID 123878290

IUPAC9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine
SMILESCCNc1ccc(C2(c3ccc(C)cc3)C3=C(C=CC(c4ccccc4)C3)c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc32)cc1
InChIInChI=1S/C58H48N2/c1-3-59-50-30-28-49(29-31-50)58(48-26-19-41(2)20-27-48)56-39-47(44-17-11-6-12-18-44)25-37-54(56)55-38-36-53(40-57(55)58)60(51-32-21-45(22-33-51)42-13-7-4-8-14-42)52-34-23-46(24-35-52)43-15-9-5-10-16-43/h4-38,40,47,59H,3,39H2,1-2H3
InChIKeyMLCVSIFUPXXBMX-UHFFFAOYSA-N
MW773.04 g/mol
LogP15.08
Rot. Bonds10

About 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine

9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine (PubChem CID 123878290) has the molecular formula C58H48N2 and a molecular weight of 773.04 g/mol. Its IUPAC name is 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine.

Molecular Properties

Compound Name9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine
PubChem CID123878290
Molecular FormulaC58H48N2
Molecular Weight773.04 g/mol
Exact Mass772.38
IUPAC Name9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine
SMILESCCNc1ccc(C2(c3ccc(C)cc3)C3=C(C=CC(c4ccccc4)C3)c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc32)cc1
InChIInChI=1S/C58H48N2/c1-3-59-50-30-28-49(29-31-50)58(48-26-19-41(2)20-27-48)56-39-47(44-17-11-6-12-18-44)25-37-54(56)55-38-36-53(40-57(55)58)60(51-32-21-45(22-33-51)42-13-7-4-8-14-42)52-34-23-46(24-35-52)43-15-9-5-10-16-43/h4-38,40,47,59H,3,39H2,1-2H3
InChIKeyMLCVSIFUPXXBMX-UHFFFAOYSA-N
XLogP15.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500773.04
LogP ≤ 515.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-(4-methylphenyl)-7,9-diphenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine
CID 90277846
2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine
CID 58795183
5-carbazol-9-yl-N-(2,4-diphenylcyclohexa-1,5-dien-1-yl)-9,9-bis(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 166895480
9-(4-methylphenyl)-9-phenyl-N-(3-phenylphenyl)-N,7-bis(4-phenylphenyl)fluoren-2-amine
CID 90277842
9-(4-methylphenyl)-N-[9-(4-methylphenyl)-9-phenylfluoren-3-yl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 177067075
4-[9-(4-methylphenyl)-2-(4-phenyl-N-(4-phenylphenyl)anilino)fluoren-9-yl]phenol
CID 154985556
N-(4-methylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381203
9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine
CID 118049371
9-N-[4-(ethylamino)phenyl]-5-N,9-N-bis(4-methylphenyl)-7,7-diphenyl-5-N-[4-(trimethyl-λ4-sulfanyl)phenyl]benzo[c]fluorene-5,9-diamine
CID 170242982
N-[9,9-bis(4-tert-butylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9,9-bis(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 158846091
2-N,2-N',2-N',7-N,7-N'-pentakis(4-methylphenyl)-2-N,7-N,7-N'-triphenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine
CID 129292300
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320

Frequently Asked Questions

What is the IUPAC name of 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine?
The IUPAC name of 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine (CID 123878290) is 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine.
What is the SMILES notation for 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine?
The canonical SMILES for 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine is CCNc1ccc(C2(c3ccc(C)cc3)C3=C(C=CC(c4ccccc4)C3)c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc32)cc1.
What is the InChIKey of 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine?
The InChIKey is MLCVSIFUPXXBMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H48N2/c1-3-59-50-30-28-49(29-31-50)58(48-26-19-41(2)20-27-48)56-39-47(44-17-11-6-12-18-44)25-37-54(56)55-38-36-53(40-57(55)58)60(51-32-21-45(22-33-51)42-13-7-4-8-14-42)52-34-23-46(24-35-52)43-15-9-5-10-16-43/h4-38,40,47,59H,3,39H2,1-2H3.
What are the key properties of 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine?
9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine has a molecular weight of 773.04 g/mol, XLogP of 15.08, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(ethylamino)phenyl]-9-(4-methylphenyl)-7-phenyl-N,N-bis(4-phenylphenyl)-7,8-dihydrofluoren-2-amine is sourced from PubChem (CID 123878290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).