N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine

C56H41NO — CID 171741100

IUPACN-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine
SMILESCC(C)c1cccc2c1-c1ccc(N(c3cc4ccccc4cc3-c3ccccc3)c3cccc4oc5ccccc5c34)cc1C2(c1ccccc1)c1ccccc1
InChIInChI=1S/C56H41NO/c1-37(2)44-27-16-28-48-54(44)45-33-32-43(36-49(45)56(48,41-22-8-4-9-23-41)42-24-10-5-11-25-42)57(50-29-17-31-53-55(50)46-26-14-15-30-52(46)58-53)51-35-40-21-13-12-20-39(40)34-47(51)38-18-6-3-7-19-38/h3-37H,1-2H3
InChIKeyLUTQQLNFVNGSDT-UHFFFAOYSA-N
MW743.95 g/mol
LogP15.36
Rot. Bonds7

About N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine

N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine (PubChem CID 171741100) has the molecular formula C56H41NO and a molecular weight of 743.95 g/mol. Its IUPAC name is N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine.

Molecular Properties

Compound NameN-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine
PubChem CID171741100
Molecular FormulaC56H41NO
Molecular Weight743.95 g/mol
Exact Mass743.32
IUPAC NameN-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine
SMILESCC(C)c1cccc2c1-c1ccc(N(c3cc4ccccc4cc3-c3ccccc3)c3cccc4oc5ccccc5c34)cc1C2(c1ccccc1)c1ccccc1
InChIInChI=1S/C56H41NO/c1-37(2)44-27-16-28-48-54(44)45-33-32-43(36-49(45)56(48,41-22-8-4-9-23-41)42-24-10-5-11-25-42)57(50-29-17-31-53-55(50)46-26-14-15-30-52(46)58-53)51-35-40-21-13-12-20-39(40)34-47(51)38-18-6-3-7-19-38/h3-37H,1-2H3
InChIKeyLUTQQLNFVNGSDT-UHFFFAOYSA-N
XLogP15.36
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500743.95
LogP ≤ 515.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-9,9-diphenyl-N-(3-phenylnaphthalen-2-yl)-5-propan-2-ylfluoren-2-amine
CID 171741158
N-(9,9-diphenylfluoren-2-yl)-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-1-amine
CID 170302496
N-(9,9-diphenylfluoren-4-yl)-N-(4-naphthalen-2-ylphenyl)dibenzofuran-1-amine
CID 172544755
1-N,3-N-di(dibenzofuran-1-yl)-1-N-(9,9-dimethylfluoren-2-yl)-3-N-(9,9-diphenylfluoren-4-yl)benzene-1,3-diamine
CID 155312683
N-(7,7-diphenylbenzo[g]fluoren-8-yl)-N-phenyldibenzofuran-1-amine;N-(9,9-diphenylfluoren-2-yl)-N,7,7-triphenylbenzo[g]fluoren-8-amine;N-naphthalen-2-yl-7,7-diphenyl-N-(4-phenylphenyl)benzo[g]fluoren-8-amine;N,7,7-triphenyl-N-(2-phenylphenyl)benzo[g]fluoren-8-amine
CID 162173102
N-(9,9-dimethyl-5-phenylfluoren-3-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-1-amine
CID 169039724
1-N,3-N-di(dibenzofuran-1-yl)-1-N-(9,9-dimethylfluoren-4-yl)-3-N-(9,9-diphenylfluoren-4-yl)benzene-1,3-diamine
CID 152916526
N-(4-dibenzofuran-2-ylphenyl)-5-methyl-9,9-diphenyl-N-[4-(3-phenylnaphthalen-2-yl)phenyl]fluoren-2-amine
CID 171740826
N-[4-[4-[bis(7-methyl-9,9-diphenylfluoren-2-yl)amino]phenyl]phenyl]-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-1-amine
CID 177287521
N-(9,9-diphenylfluoren-2-yl)-12-naphthalen-2-yl-N-(2-phenylphenyl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14,16,18-nonaen-8-amine
CID 157452132
N-(9,9-diphenylfluoren-4-yl)-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 170119694
N-(2-dibenzofuran-1-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-9,9-diphenylfluoren-2-amine
CID 167324852

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine?
The IUPAC name of N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine (CID 171741100) is N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine.
What is the SMILES notation for N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine?
The canonical SMILES for N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine is CC(C)c1cccc2c1-c1ccc(N(c3cc4ccccc4cc3-c3ccccc3)c3cccc4oc5ccccc5c34)cc1C2(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine?
The InChIKey is LUTQQLNFVNGSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H41NO/c1-37(2)44-27-16-28-48-54(44)45-33-32-43(36-49(45)56(48,41-22-8-4-9-23-41)42-24-10-5-11-25-42)57(50-29-17-31-53-55(50)46-26-14-15-30-52(46)58-53)51-35-40-21-13-12-20-39(40)34-47(51)38-18-6-3-7-19-38/h3-37H,1-2H3.
What are the key properties of N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine?
N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine has a molecular weight of 743.95 g/mol, XLogP of 15.36, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenyl-5-propan-2-ylfluoren-2-yl)-N-(3-phenylnaphthalen-2-yl)dibenzofuran-1-amine is sourced from PubChem (CID 171741100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).