N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine

C53H35NO — CID 138669005

IUPACN-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine
SMILESc1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4ccc(C5(c6ccc7ccccc7c6)c6ccccc6-c6ccccc65)cc4)cccc23)cc1
InChIInChI=1S/C53H35NO/c1-3-16-37(17-4-1)43-23-13-24-46-47-25-14-28-50(52(47)55-51(43)46)54(41-19-5-2-6-20-41)42-33-31-39(32-34-42)53(40-30-29-36-15-7-8-18-38(36)35-40)48-26-11-9-21-44(48)45-22-10-12-27-49(45)53/h1-35H
InChIKeyINCJSTJKORUTSE-UHFFFAOYSA-N
MW701.87 g/mol
LogP14.24
Rot. Bonds6

About N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine

N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine (PubChem CID 138669005) has the molecular formula C53H35NO and a molecular weight of 701.87 g/mol. Its IUPAC name is N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine.

Molecular Properties

Compound NameN-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine
PubChem CID138669005
Molecular FormulaC53H35NO
Molecular Weight701.87 g/mol
Exact Mass701.27
IUPAC NameN-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine
SMILESc1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4ccc(C5(c6ccc7ccccc7c6)c6ccccc6-c6ccccc65)cc4)cccc23)cc1
InChIInChI=1S/C53H35NO/c1-3-16-37(17-4-1)43-23-13-24-46-47-25-14-28-50(52(47)55-51(43)46)54(41-19-5-2-6-20-41)42-33-31-39(32-34-42)53(40-30-29-36-15-7-8-18-38(36)35-40)48-26-11-9-21-44(48)45-22-10-12-27-49(45)53/h1-35H
InChIKeyINCJSTJKORUTSE-UHFFFAOYSA-N
XLogP14.24
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500701.87
LogP ≤ 514.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-naphthalen-2-ylfluoren-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164769036
7-N',17-N'-diphenyl-7-N',17-N'-bis(6-phenyldibenzofuran-4-yl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine
CID 137492765
6-[4-(2-naphthalen-2-ylphenyl)phenyl]-N-phenyl-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 134433049
N-[9,9-bis(4-ethenylphenyl)fluoren-3-yl]-6-phenyl-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 134415343
2-(9,9-diphenylfluoren-3-yl)-N-(3-naphthalen-1-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)aniline
CID 177121467
4-phenyl-N-[4-[6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 164724700
N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-10-amine
CID 177121378
N-(9,9-diphenylfluoren-2-yl)-6-(9-phenylfluoren-9-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 169021988
4-[6-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-yl]-N,N-bis(4-phenylphenyl)naphthalen-1-amine
CID 164724674
N,8-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-amine
CID 139384360
N-(4-dibenzofuran-4-ylphenyl)-N-[2-(9,9-diphenylfluoren-2-yl)phenyl]naphthalen-2-amine
CID 170676879
N-[4-(3-methyl-9,9'-spirobi[fluorene]-2'-yl)phenyl]-N-naphthalen-2-yl-6-phenyldibenzofuran-4-amine
CID 176652213

Frequently Asked Questions

What is the IUPAC name of N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine?
The IUPAC name of N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine (CID 138669005) is N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine.
What is the SMILES notation for N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine?
The canonical SMILES for N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine is c1ccc(-c2cccc3c2oc2c(N(c4ccccc4)c4ccc(C5(c6ccc7ccccc7c6)c6ccccc6-c6ccccc65)cc4)cccc23)cc1.
What is the InChIKey of N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine?
The InChIKey is INCJSTJKORUTSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H35NO/c1-3-16-37(17-4-1)43-23-13-24-46-47-25-14-28-50(52(47)55-51(43)46)54(41-19-5-2-6-20-41)42-33-31-39(32-34-42)53(40-30-29-36-15-7-8-18-38(36)35-40)48-26-11-9-21-44(48)45-22-10-12-27-49(45)53/h1-35H.
What are the key properties of N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine?
N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine has a molecular weight of 701.87 g/mol, XLogP of 14.24, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9-naphthalen-2-ylfluoren-9-yl)phenyl]-N,6-diphenyldibenzofuran-4-amine is sourced from PubChem (CID 138669005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).