8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine

C52H35NO — CID 171752030

IUPAC8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc4c5cc(-c6ccccc6)cc(-c6ccccc6)c5oc4c4ccccc34)cc2)cc1
InChIInChI=1S/C52H35NO/c1-5-15-36(16-6-1)39-25-29-43(30-26-39)53(44-31-27-40(28-32-44)37-17-7-2-8-18-37)50-35-49-48-34-42(38-19-9-3-10-20-38)33-47(41-21-11-4-12-22-41)52(48)54-51(49)46-24-14-13-23-45(46)50/h1-35H
InChIKeyDXSDVWAMSDHREG-UHFFFAOYSA-N
MW689.86 g/mol
LogP14.88
Rot. Bonds7

About 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine

8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine (PubChem CID 171752030) has the molecular formula C52H35NO and a molecular weight of 689.86 g/mol. Its IUPAC name is 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine.

Molecular Properties

Compound Name8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
PubChem CID171752030
Molecular FormulaC52H35NO
Molecular Weight689.86 g/mol
Exact Mass689.27
IUPAC Name8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc4c5cc(-c6ccccc6)cc(-c6ccccc6)c5oc4c4ccccc34)cc2)cc1
InChIInChI=1S/C52H35NO/c1-5-15-36(16-6-1)39-25-29-43(30-26-39)53(44-31-27-40(28-32-44)37-17-7-2-8-18-37)50-35-49-48-34-42(38-19-9-3-10-20-38)33-47(41-21-11-4-12-22-41)52(48)54-51(49)46-24-14-13-23-45(46)50/h1-35H
InChIKeyDXSDVWAMSDHREG-UHFFFAOYSA-N
XLogP14.88
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500689.86
LogP ≤ 514.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-phenyl-N,N,2-tris(4-phenylphenyl)dibenzofuran-4-amine
CID 168771919
N,N-bis(4-naphthalen-1-ylphenyl)-2,6-diphenyldibenzofuran-4-amine
CID 168771985
8-phenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 167143670
N-phenyl-N,5-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 167144324
2-phenyl-N-[4-(5-phenylnaphtho[1,2-b][1]benzofuran-10-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 167143735
N,8-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 170675105
N-(4-naphthalen-1-ylphenyl)-10-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-4-amine
CID 167277162
5,9-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine
CID 171752136
N-(9,9-dimethylfluoren-2-yl)-10-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 167144181
N-(4-phenanthren-2-ylphenyl)-10-phenyl-N-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 167144378
7-[4-(N-phenylanilino)phenyl]-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 155423690
N,6-diphenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-4-amine
CID 71126851

Frequently Asked Questions

What is the IUPAC name of 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
The IUPAC name of 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine (CID 171752030) is 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine.
What is the SMILES notation for 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
The canonical SMILES for 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc4c5cc(-c6ccccc6)cc(-c6ccccc6)c5oc4c4ccccc34)cc2)cc1.
What is the InChIKey of 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
The InChIKey is DXSDVWAMSDHREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H35NO/c1-5-15-36(16-6-1)39-25-29-43(30-26-39)53(44-31-27-40(28-32-44)37-17-7-2-8-18-37)50-35-49-48-34-42(38-19-9-3-10-20-38)33-47(41-21-11-4-12-22-41)52(48)54-51(49)46-24-14-13-23-45(46)50/h1-35H.
What are the key properties of 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine has a molecular weight of 689.86 g/mol, XLogP of 14.88, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,10-diphenyl-N,N-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine is sourced from PubChem (CID 171752030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).