N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine

C56H41N — CID 146364238

IUPACN-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c5c(ccc4c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)c3ccccc3-c3ccccc3)cc21
InChIInChI=1S/C56H41N/c1-55(2)49-27-15-12-25-46(49)47-34-32-43(37-52(47)55)57(53-29-17-14-24-44(53)38-18-6-3-7-19-38)42-31-33-45-39(36-42)30-35-51-54(45)48-26-13-16-28-50(48)56(51,40-20-8-4-9-21-40)41-22-10-5-11-23-41/h3-37H,1-2H3
InChIKeyYOCWRRNCFOHZAX-UHFFFAOYSA-N
MW727.95 g/mol
LogP14.65
Rot. Bonds6

About N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine

N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine (PubChem CID 146364238) has the molecular formula C56H41N and a molecular weight of 727.95 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine
PubChem CID146364238
Molecular FormulaC56H41N
Molecular Weight727.95 g/mol
Exact Mass727.32
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c5c(ccc4c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)c3ccccc3-c3ccccc3)cc21
InChIInChI=1S/C56H41N/c1-55(2)49-27-15-12-25-46(49)47-34-32-43(37-52(47)55)57(53-29-17-14-24-44(53)38-18-6-3-7-19-38)42-31-33-45-39(36-42)30-35-51-54(45)48-26-13-16-28-50(48)56(51,40-20-8-4-9-21-40)41-22-10-5-11-23-41/h3-37H,1-2H3
InChIKeyYOCWRRNCFOHZAX-UHFFFAOYSA-N
XLogP14.65
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500727.95
LogP ≤ 514.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-diphenylfluoren-4-yl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine
CID 126548400
N-[3-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine
CID 122607124
N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 134487972
N-[4-(7,7-diphenylbenzo[c]fluoren-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 146364220
N-(9,9-dimethylfluoren-4-yl)-9,9-diphenyl-N-(2-phenylphenyl)fluoren-2-amine
CID 121285745
N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-3-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 158470030
7,7-dimethyl-N-phenyl-N-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]benzo[c]fluoren-10-amine
CID 169293026
N-(9,9-dimethylfluoren-4-yl)-9,9-diphenyl-N-(2-phenylphenyl)fluoren-3-amine
CID 134487997
N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-ylspiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 165158535
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine;N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 159953736
N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine
CID 118298195
N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-3-yl)-9,9'-spirobi[fluorene]-4-amine
CID 121423710

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine (CID 146364238) is N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4c5c(ccc4c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)c3ccccc3-c3ccccc3)cc21.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine?
The InChIKey is YOCWRRNCFOHZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H41N/c1-55(2)49-27-15-12-25-46(49)47-34-32-43(37-52(47)55)57(53-29-17-14-24-44(53)38-18-6-3-7-19-38)42-31-33-45-39(36-42)30-35-51-54(45)48-26-13-16-28-50(48)56(51,40-20-8-4-9-21-40)41-22-10-5-11-23-41/h3-37H,1-2H3.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine?
N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine has a molecular weight of 727.95 g/mol, XLogP of 14.65, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-7,7-diphenyl-N-(2-phenylphenyl)benzo[c]fluoren-3-amine is sourced from PubChem (CID 146364238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).