9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine

C50H36BrN — CID 118049371

IUPAC9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccc(C2(c3ccccc3Br)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc32)cc1
InChIInChI=1S/C50H36BrN/c1-35-20-26-40(27-21-35)50(47-18-10-11-19-49(47)51)46-17-9-8-16-44(46)45-33-32-43(34-48(45)50)52(41-28-22-38(23-29-41)36-12-4-2-5-13-36)42-30-24-39(25-31-42)37-14-6-3-7-15-37/h2-34H,1H3
InChIKeyOXPQDCVFJSKVER-UHFFFAOYSA-N
MW730.75 g/mol
LogP13.92
Rot. Bonds7

About 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine

9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine (PubChem CID 118049371) has the molecular formula C50H36BrN and a molecular weight of 730.75 g/mol. Its IUPAC name is 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine
PubChem CID118049371
Molecular FormulaC50H36BrN
Molecular Weight730.75 g/mol
Exact Mass729.20
IUPAC Name9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccc(C2(c3ccccc3Br)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc32)cc1
InChIInChI=1S/C50H36BrN/c1-35-20-26-40(27-21-35)50(47-18-10-11-19-49(47)51)46-17-9-8-16-44(46)45-33-32-43(34-48(45)50)52(41-28-22-38(23-29-41)36-12-4-2-5-13-36)42-30-24-39(25-31-42)37-14-6-3-7-15-37/h2-34H,1H3
InChIKeyOXPQDCVFJSKVER-UHFFFAOYSA-N
XLogP13.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500730.75
LogP ≤ 513.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-(2-bromophenyl)-N-[9-(2-bromophenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 122537273
N-[4-[9-(2-bromophenyl)-2,7-diphenylfluoren-9-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 122537250
9-(2-bromophenyl)-N,N-bis(4-phenylphenyl)-9-[3-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]fluoren-2-amine
CID 122537274
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
2-N,7-N-bis(4-methylphenyl)-9-phenyl-2-N,7-N,9-tris(4-phenylphenyl)fluorene-2,7-diamine
CID 58795183
4-[9-(4-methylphenyl)-2-(4-phenyl-N-(4-phenylphenyl)anilino)fluoren-9-yl]phenol
CID 154985556
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
N-[4-[4-(N-(2',7'-dimethyl-9,9'-spirobi[fluorene]-2-yl)anilino)phenyl]phenyl]-2',7'-dimethyl-N-phenyl-9,9'-spirobi[fluorene]-2-amine
CID 158001186
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 118641092
2-methyl-N,N,7'-triphenyl-9,9'-spirobi[fluorene]-2'-amine
CID 21042261

Frequently Asked Questions

What is the IUPAC name of 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine (CID 118049371) is 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine is Cc1ccc(C2(c3ccccc3Br)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc32)cc1.
What is the InChIKey of 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The InChIKey is OXPQDCVFJSKVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H36BrN/c1-35-20-26-40(27-21-35)50(47-18-10-11-19-49(47)51)46-17-9-8-16-44(46)45-33-32-43(34-48(45)50)52(41-28-22-38(23-29-41)36-12-4-2-5-13-36)42-30-24-39(25-31-42)37-14-6-3-7-15-37/h2-34H,1H3.
What are the key properties of 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine?
9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine has a molecular weight of 730.75 g/mol, XLogP of 13.92, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-bromophenyl)-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 118049371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).