N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine

C36H23NO2 — CID 90350985

IUPACN-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C36H23NO2/c1-2-8-26(9-3-1)37(28-19-21-36-32(23-28)30-11-5-7-13-34(30)39-36)27-17-14-24(15-18-27)25-16-20-35-31(22-25)29-10-4-6-12-33(29)38-35/h1-23H
InChIKeyFQPUKMKIDRNVKT-UHFFFAOYSA-N
MW501.59 g/mol
LogP10.62
Rot. Bonds4

About N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine

N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine (PubChem CID 90350985) has the molecular formula C36H23NO2 and a molecular weight of 501.59 g/mol. Its IUPAC name is N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine
PubChem CID90350985
Molecular FormulaC36H23NO2
Molecular Weight501.59 g/mol
Exact Mass501.17
IUPAC NameN-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C36H23NO2/c1-2-8-26(9-3-1)37(28-19-21-36-32(23-28)30-11-5-7-13-34(30)39-36)27-17-14-24(15-18-27)25-16-20-35-31(22-25)29-10-4-6-12-33(29)38-35/h1-23H
InChIKeyFQPUKMKIDRNVKT-UHFFFAOYSA-N
XLogP10.62
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500501.59
LogP ≤ 510.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 174245859
3-dibenzofuran-2-yl-N,N-bis(4-phenylphenyl)aniline
CID 121327922
1-N,3-N,5-N-tris(4-dibenzofuran-2-ylphenyl)-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 118605062
N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 118405736
N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline
CID 58510590
N-dibenzofuran-2-yl-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 121325419
3-dibenzofuran-2-yl-N-(3-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)aniline
CID 118428337
3-N,3-N-bis(4-dibenzofuran-2-ylphenyl)-1-N,5-N-diphenyl-1-N,5-N-bis(4-phenylphenyl)benzene-1,3,5-triamine
CID 118605075
N,N-diphenyldibenzofuran-2-amine
CID 58038469
2-N-dibenzofuran-3-yl-2-N,7-N-diphenyl-7-N-(4-phenylphenyl)dibenzofuran-2,7-diamine
CID 146576058
8-N-dibenzofuran-3-yl-2-N,8-N-diphenyl-2-N-(4-phenylphenyl)dibenzofuran-2,8-diamine
CID 146576028
3-N-dibenzofuran-2-yl-1-N,1-N,3-N,5-N,5-N-pentakis(4-phenylphenyl)benzene-1,3,5-triamine
CID 118605058

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine?
The IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine (CID 90350985) is N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine.
What is the SMILES notation for N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine?
The canonical SMILES for N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine is c1ccc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3oc4ccccc4c3c2)cc1.
What is the InChIKey of N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine?
The InChIKey is FQPUKMKIDRNVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23NO2/c1-2-8-26(9-3-1)37(28-19-21-36-32(23-28)30-11-5-7-13-34(30)39-36)27-17-14-24(15-18-27)25-16-20-35-31(22-25)29-10-4-6-12-33(29)38-35/h1-23H.
What are the key properties of N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine?
N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine has a molecular weight of 501.59 g/mol, XLogP of 10.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine is sourced from PubChem (CID 90350985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).