2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine

C69H52N2 — CID 58795183

IUPAC2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine
SMILESCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc(-c4ccccc4)cc2)c2cc(N(c4ccc(C)cc4)c4ccc(-c5ccccc5)cc4)ccc2-3)cc1
InChIInChI=1S/C69H52N2/c1-49-23-35-59(36-24-49)70(61-39-29-55(30-40-61)52-17-9-4-10-18-52)63-43-45-65-66-46-44-64(71(60-37-25-50(2)26-38-60)62-41-31-56(32-42-62)53-19-11-5-12-20-53)48-68(66)69(67(65)47-63,57-21-13-6-14-22-57)58-33-27-54(28-34-58)51-15-7-3-8-16-51/h3-48H,1-2H3
InChIKeyMFAFOQXZOZRIFM-UHFFFAOYSA-N
MW909.19 g/mol
LogP18.61
Rot. Bonds11

About 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine

2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine (PubChem CID 58795183) has the molecular formula C69H52N2 and a molecular weight of 909.19 g/mol. Its IUPAC name is 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine.

Molecular Properties

Compound Name2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine
PubChem CID58795183
Molecular FormulaC69H52N2
Molecular Weight909.19 g/mol
Exact Mass908.41
IUPAC Name2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine
SMILESCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc(-c4ccccc4)cc2)c2cc(N(c4ccc(C)cc4)c4ccc(-c5ccccc5)cc4)ccc2-3)cc1
InChIInChI=1S/C69H52N2/c1-49-23-35-59(36-24-49)70(61-39-29-55(30-40-61)52-17-9-4-10-18-52)63-43-45-65-66-46-44-64(71(60-37-25-50(2)26-38-60)62-41-31-56(32-42-62)53-19-11-5-12-20-53)48-68(66)69(67(65)47-63,57-21-13-6-14-22-57)58-33-27-54(28-34-58)51-15-7-3-8-16-51/h3-48H,1-2H3
InChIKeyMFAFOQXZOZRIFM-UHFFFAOYSA-N
XLogP18.61
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500909.19
LogP ≤ 518.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine with MolForge

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Related Compounds

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
N-(4-methylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381203
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
4-[9-(4-methylphenyl)-2-(4-phenyl-N-(4-phenylphenyl)anilino)fluoren-9-yl]phenol
CID 154985556
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
9,9-dimethyl-N-(4-phenylphenyl)-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]fluoren-2-amine
CID 163787902
9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine
CID 118049371
7-[7-[9,9-diphenyl-7-(N-phenylanilino)fluoren-2-yl]-9,9-diphenylfluoren-2-yl]-N,N,9,9-tetraphenylfluoren-2-amine
CID 101429725
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-[4-(4-methylphenyl)phenyl]-9-phenyl-2,7-bis(4-phenylphenyl)fluorene
CID 58894820
9-(4-tert-butylphenyl)-N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 177067003

Frequently Asked Questions

What is the IUPAC name of 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine?
The IUPAC name of 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine (CID 58795183) is 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine.
What is the SMILES notation for 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine?
The canonical SMILES for 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine is Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc(-c4ccccc4)cc2)c2cc(N(c4ccc(C)cc4)c4ccc(-c5ccccc5)cc4)ccc2-3)cc1.
What is the InChIKey of 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine?
The InChIKey is MFAFOQXZOZRIFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H52N2/c1-49-23-35-59(36-24-49)70(61-39-29-55(30-40-61)52-17-9-4-10-18-52)63-43-45-65-66-46-44-64(71(60-37-25-50(2)26-38-60)62-41-31-56(32-42-62)53-19-11-5-12-20-53)48-68(66)69(67(65)47-63,57-21-13-6-14-22-57)58-33-27-54(28-34-58)51-15-7-3-8-16-51/h3-48H,1-2H3.
What are the key properties of 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine?
2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine has a molecular weight of 909.19 g/mol, XLogP of 18.61, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine is sourced from PubChem (CID 58795183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).