N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine

C40H27NO — CID 167234331

IUPACN-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine
SMILESc1ccc(-c2ccc(-c3cccc4ccccc34)cc2N(c2ccccc2)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/C40H27NO/c1-3-13-29(14-4-1)34-26-25-30(33-21-11-16-28-15-7-8-19-32(28)33)27-37(34)41(31-17-5-2-6-18-31)36-22-12-24-39-40(36)35-20-9-10-23-38(35)42-39/h1-27H
InChIKeyLJYQOPSKGKLGSU-UHFFFAOYSA-N
MW537.66 g/mol
LogP11.54
Rot. Bonds5

About N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine

N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine (PubChem CID 167234331) has the molecular formula C40H27NO and a molecular weight of 537.66 g/mol. Its IUPAC name is N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine.

Molecular Properties

Compound NameN-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine
PubChem CID167234331
Molecular FormulaC40H27NO
Molecular Weight537.66 g/mol
Exact Mass537.21
IUPAC NameN-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine
SMILESc1ccc(-c2ccc(-c3cccc4ccccc34)cc2N(c2ccccc2)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/C40H27NO/c1-3-13-29(14-4-1)34-26-25-30(33-21-11-16-28-15-7-8-19-32(28)33)27-37(34)41(31-17-5-2-6-18-31)36-22-12-24-39-40(36)35-20-9-10-23-38(35)42-39/h1-27H
InChIKeyLJYQOPSKGKLGSU-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-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(5-naphthalen-2-yl-2-phenylphenyl)dibenzofuran-1-amine
CID 167234974
N-(4-dibenzofuran-1-ylphenyl)-5-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-2-phenylaniline
CID 167234839
N-(4-phenanthren-2-ylphenyl)-N-(5-phenanthren-1-yl-2-phenylphenyl)dibenzofuran-1-amine
CID 167234406
N-(3-dibenzofuran-1-ylphenyl)-5-naphthalen-1-yl-2-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167233850
N-(3-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine
CID 176810710
N-(4-dibenzofuran-4-ylphenyl)-N-(5-phenanthren-1-yl-2-phenylphenyl)dibenzofuran-1-amine
CID 167234637
5-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-2-phenyl-N-(2-phenylphenyl)aniline
CID 167234762
N-(5-naphthalen-1-yl-2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 167234918
5-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-N,2-diphenylaniline
CID 167236233
N-(4-dibenzofuran-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-5-phenanthren-9-yl-2-phenylaniline
CID 167235443
N-[4-(3-phenylnaphthalen-2-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 154605463
N-(4-dibenzofuran-1-ylphenyl)-N-(5-naphthalen-1-yl-2-phenylphenyl)dibenzothiophen-4-amine
CID 167234327

Frequently Asked Questions

What is the IUPAC name of N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine?
The IUPAC name of N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine (CID 167234331) is N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine.
What is the SMILES notation for N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine?
The canonical SMILES for N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine is c1ccc(-c2ccc(-c3cccc4ccccc34)cc2N(c2ccccc2)c2cccc3oc4ccccc4c23)cc1.
What is the InChIKey of N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine?
The InChIKey is LJYQOPSKGKLGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27NO/c1-3-13-29(14-4-1)34-26-25-30(33-21-11-16-28-15-7-8-19-32(28)33)27-37(34)41(31-17-5-2-6-18-31)36-22-12-24-39-40(36)35-20-9-10-23-38(35)42-39/h1-27H.
What are the key properties of N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine?
N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-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-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine is sourced from PubChem (CID 167234331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).