N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine

C56H37NO — CID 167143851

IUPACN,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine
SMILESc1ccc(-c2cccc(-c3cc4c5cccc(-c6ccc(N(c7ccccc7)c7ccc(-c8ccccc8)c8ccccc78)cc6)c5oc4c4ccccc34)c2)cc1
InChIInChI=1S/C56H37NO/c1-4-16-38(17-5-1)41-20-14-21-42(36-41)52-37-53-51-29-15-28-46(55(51)58-56(53)50-27-13-11-25-48(50)52)40-30-32-44(33-31-40)57(43-22-8-3-9-23-43)54-35-34-45(39-18-6-2-7-19-39)47-24-10-12-26-49(47)54/h1-37H
InChIKeyDUGNHBFBINLIQS-UHFFFAOYSA-N
MW739.92 g/mol
LogP16.03
Rot. Bonds7

About N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine

N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine (PubChem CID 167143851) has the molecular formula C56H37NO and a molecular weight of 739.92 g/mol. Its IUPAC name is N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine
PubChem CID167143851
Molecular FormulaC56H37NO
Molecular Weight739.92 g/mol
Exact Mass739.29
IUPAC NameN,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine
SMILESc1ccc(-c2cccc(-c3cc4c5cccc(-c6ccc(N(c7ccccc7)c7ccc(-c8ccccc8)c8ccccc78)cc6)c5oc4c4ccccc34)c2)cc1
InChIInChI=1S/C56H37NO/c1-4-16-38(17-5-1)41-20-14-21-42(36-41)52-37-53-51-29-15-28-46(55(51)58-56(53)50-27-13-11-25-48(50)52)40-30-32-44(33-31-40)57(43-22-8-3-9-23-43)54-35-34-45(39-18-6-2-7-19-39)47-24-10-12-26-49(47)54/h1-37H
InChIKeyDUGNHBFBINLIQS-UHFFFAOYSA-N
XLogP16.03
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500739.92
LogP ≤ 516.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-diphenyl-N-[4-(10-phenylnaphtho[1,2-b][1]benzofuran-5-yl)phenyl]aniline
CID 167402762
2-phenyl-N-[4-(5-phenylnaphtho[1,2-b][1]benzofuran-10-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 167143735
N-phenyl-N,5-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-amine
CID 167144324
4-phenyl-N-[4-[3-[4-(6-phenyldibenzofuran-4-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 121296601
N-(4-naphthalen-2-ylphenyl)-2,6-diphenyl-N-(4-phenylnaphthalen-1-yl)dibenzofuran-4-amine
CID 168772002
3-dibenzofuran-4-yl-N,N-bis[4-[4-(4-methylphenyl)phenyl]phenyl]aniline;3-dibenzofuran-4-yl-N,N-bis[4-(2-phenylphenyl)phenyl]aniline;N-(3-dibenzofuran-4-ylphenyl)-4-phenyl-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 159464341
N,4-diphenyl-N-[4-[4-(6-phenyldibenzofuran-4-yl)naphthalen-1-yl]phenyl]aniline
CID 130208173
N-(4-naphthalen-1-ylphenyl)-10-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-4-amine
CID 167277162
4-dibenzofuran-4-yl-N-phenyl-N-[4-(5-phenylnaphtho[1,2-b][1]benzofuran-10-yl)phenyl]aniline
CID 167143311
N,4-diphenyl-N-[4-[3-(6-phenyldibenzofuran-4-yl)phenyl]phenyl]aniline;N-[4-[3-(6-naphthalen-1-yldibenzofuran-4-yl)phenyl]phenyl]-N,4-diphenylaniline;N-[4-[3-(6-naphthalen-1-yldibenzofuran-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;4-phenyl-N-[4-[3-(6-phenyldibenzofuran-4-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 159878876
6-phenyl-N,N,2-tris(4-phenylphenyl)dibenzofuran-4-amine
CID 168771919
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 N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine?
The IUPAC name of N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine (CID 167143851) is N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine.
What is the SMILES notation for N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine?
The canonical SMILES for N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine is c1ccc(-c2cccc(-c3cc4c5cccc(-c6ccc(N(c7ccccc7)c7ccc(-c8ccccc8)c8ccccc78)cc6)c5oc4c4ccccc34)c2)cc1.
What is the InChIKey of N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine?
The InChIKey is DUGNHBFBINLIQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37NO/c1-4-16-38(17-5-1)41-20-14-21-42(36-41)52-37-53-51-29-15-28-46(55(51)58-56(53)50-27-13-11-25-48(50)52)40-30-32-44(33-31-40)57(43-22-8-3-9-23-43)54-35-34-45(39-18-6-2-7-19-39)47-24-10-12-26-49(47)54/h1-37H.
What are the key properties of N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine?
N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine has a molecular weight of 739.92 g/mol, XLogP of 16.03, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diphenyl-N-[4-[5-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]naphthalen-1-amine is sourced from PubChem (CID 167143851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).