6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine

C40H26BrNO — CID 121443813

IUPAC6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine
SMILESBrc1cc(-c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c2)cc(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C40H26BrNO/c41-33-23-31(22-32(24-33)30-18-20-40-38(26-30)37-13-7-8-14-39(37)43-40)28-15-16-29-25-36(19-17-27(29)21-28)42(34-9-3-1-4-10-34)35-11-5-2-6-12-35/h1-26H
InChIKeyULCGSGNRJLUHLZ-UHFFFAOYSA-N
MW616.56 g/mol
LogP12.31
Rot. Bonds5

About 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine

6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine (PubChem CID 121443813) has the molecular formula C40H26BrNO and a molecular weight of 616.56 g/mol. Its IUPAC name is 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine.

Molecular Properties

Compound Name6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine
PubChem CID121443813
Molecular FormulaC40H26BrNO
Molecular Weight616.56 g/mol
Exact Mass615.12
IUPAC Name6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine
SMILESBrc1cc(-c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c2)cc(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C40H26BrNO/c41-33-23-31(22-32(24-33)30-18-20-40-38(26-30)37-13-7-8-14-39(37)43-40)28-15-16-29-25-36(19-17-27(29)21-28)42(34-9-3-1-4-10-34)35-11-5-2-6-12-35/h1-26H
InChIKeyULCGSGNRJLUHLZ-UHFFFAOYSA-N
XLogP12.31
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500616.56
LogP ≤ 512.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-16-phenyl-N-(4-phenylphenyl)pentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaen-6-amine
CID 166033497
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]naphthalen-2-amine
CID 118405802
5-bromo-3-N-dibenzofuran-2-yl-1-N-naphthalen-2-yl-1-N-phenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine
CID 122552089
3-dibenzofuran-2-yl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline
CID 170535051
6-dibenzofuran-2-yl-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine
CID 118406083
4-[3,5-di(dibenzofuran-2-yl)phenyl]-N,N-diphenylaniline;N-[4-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 160762815
N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine
CID 90350985
3,5-di(dibenzofuran-2-yl)-N,N-diphenylaniline
CID 121449955
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-phenyldibenzofuran-2-amine
CID 174256821
N-[4-[4-[3,5-di(dibenzofuran-3-yl)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121450043
N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 121325434
6-N,17-N-di(dibenzofuran-2-yl)-6-N,17-N-diphenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaene-6,17-diamine
CID 166032207

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine?
The IUPAC name of 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine (CID 121443813) is 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine.
What is the SMILES notation for 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine?
The canonical SMILES for 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine is Brc1cc(-c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c2)cc(-c2ccc3oc4ccccc4c3c2)c1.
What is the InChIKey of 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine?
The InChIKey is ULCGSGNRJLUHLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26BrNO/c41-33-23-31(22-32(24-33)30-18-20-40-38(26-30)37-13-7-8-14-39(37)43-40)28-15-16-29-25-36(19-17-27(29)21-28)42(34-9-3-1-4-10-34)35-11-5-2-6-12-35/h1-26H.
What are the key properties of 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine?
6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine has a molecular weight of 616.56 g/mol, XLogP of 12.31, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromo-5-dibenzofuran-2-ylphenyl)-N,N-diphenylnaphthalen-2-amine is sourced from PubChem (CID 121443813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).