N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine

C40H27NO — CID 170675342

IUPACN,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3ccc4oc5c6ccccc6ccc5c4c3-c3ccccc3)cc2)cc1
InChIInChI=1S/C40H27NO/c1-4-12-28(13-5-1)29-20-23-33(24-21-29)41(32-17-8-3-9-18-32)36-26-27-37-39(38(36)31-15-6-2-7-16-31)35-25-22-30-14-10-11-19-34(30)40(35)42-37/h1-27H
InChIKeyZVJDRYYFZPLBPY-UHFFFAOYSA-N
MW537.66 g/mol
LogP11.54
Rot. Bonds5

About N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine

N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine (PubChem CID 170675342) has the molecular formula C40H27NO and a molecular weight of 537.66 g/mol. Its IUPAC name is N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine.

Molecular Properties

Compound NameN,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine
PubChem CID170675342
Molecular FormulaC40H27NO
Molecular Weight537.66 g/mol
Exact Mass537.21
IUPAC NameN,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3ccc4oc5c6ccccc6ccc5c4c3-c3ccccc3)cc2)cc1
InChIInChI=1S/C40H27NO/c1-4-12-28(13-5-1)29-20-23-33(24-21-29)41(32-17-8-3-9-18-32)36-26-27-37-39(38(36)31-15-6-2-7-16-31)35-25-22-30-14-10-11-19-34(30)40(35)42-37/h1-27H
InChIKeyZVJDRYYFZPLBPY-UHFFFAOYSA-N
XLogP11.54
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.66
LogP ≤ 511.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diphenyl-10-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
CID 170675548
11-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-10-amine
CID 170675098
N-dibenzothiophen-4-yl-7-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine
CID 170239480
2-naphtho[1,2-b][1]benzofuran-7-yl-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167331209
N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738345
N-naphthalen-1-yl-N-phenyl-1-(4-phenylphenyl)dibenzofuran-2-amine
CID 177281615
N-(4-dibenzofuran-4-ylphenyl)-10-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
CID 170675432
16-phenyl-N,N-bis(4-phenylphenyl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-17-amine
CID 171433561
1-(4-naphthalen-2-ylphenyl)-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine
CID 177281230
N-phenyl-N,9-bis(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine
CID 170243077
N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-2-phenyl-N-(4-phenylphenyl)aniline
CID 167330365
N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-2-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167331276

Frequently Asked Questions

What is the IUPAC name of N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine?
The IUPAC name of N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine (CID 170675342) is N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine.
What is the SMILES notation for N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine?
The canonical SMILES for N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine is c1ccc(-c2ccc(N(c3ccccc3)c3ccc4oc5c6ccccc6ccc5c4c3-c3ccccc3)cc2)cc1.
What is the InChIKey of N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine?
The InChIKey is ZVJDRYYFZPLBPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27NO/c1-4-12-28(13-5-1)29-20-23-33(24-21-29)41(32-17-8-3-9-18-32)36-26-27-37-39(38(36)31-15-6-2-7-16-31)35-25-22-30-14-10-11-19-34(30)40(35)42-37/h1-27H.
What are the key properties of N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine?
N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine has a molecular weight of 537.66 g/mol, XLogP of 11.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-diphenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-8-amine is sourced from PubChem (CID 170675342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).