N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline

C34H29NO — CID 122413267

IUPACN-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline
SMILESCC(C)(C)N(c1ccc(-c2ccccc2)cc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C34H29NO/c1-34(2,3)35(27-20-16-25(17-21-27)24-10-5-4-6-11-24)28-22-18-26(19-23-28)29-13-9-14-31-30-12-7-8-15-32(30)36-33(29)31/h4-23H,1-3H3
InChIKeyKKJBOHKVFCDZDK-UHFFFAOYSA-N
MW467.61 g/mol
LogP9.86
Rot. Bonds4

About N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline

N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline (PubChem CID 122413267) has the molecular formula C34H29NO and a molecular weight of 467.61 g/mol. Its IUPAC name is N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline.

Molecular Properties

Compound NameN-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline
PubChem CID122413267
Molecular FormulaC34H29NO
Molecular Weight467.61 g/mol
Exact Mass467.22
IUPAC NameN-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline
SMILESCC(C)(C)N(c1ccc(-c2ccccc2)cc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C34H29NO/c1-34(2,3)35(27-20-16-25(17-21-27)24-10-5-4-6-11-24)28-22-18-26(19-23-28)29-13-9-14-31-30-12-7-8-15-32(30)36-33(29)31/h4-23H,1-3H3
InChIKeyKKJBOHKVFCDZDK-UHFFFAOYSA-N
XLogP9.86
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.61
LogP ≤ 59.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline 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

1-N,4-N-bis(4-dibenzofuran-4-ylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4-N-(4-dibenzofuran-4-ylphenyl)-1-N-[4-[4-(N-[4-(N-(4-dibenzofuran-4-ylphenyl)anilino)phenyl]anilino)phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;N-(4-dibenzofuran-4-ylphenyl)-4-[4-[4-(N-(4-dibenzofuran-4-ylphenyl)anilino)phenyl]phenyl]-N-phenylaniline;4-[4-[N-(4-dibenzofuran-4-ylphenyl)-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline
CID 167553634
1-N,4-N-bis(4-dibenzofuran-4-ylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
CID 59022075
4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-phenylaniline
CID 59022085
N-tert-butyl-N-phenyldibenzofuran-4-amine;N-(4-tert-butylphenyl)-2-phenyl-N-(4-phenylphenyl)aniline;N-(4-tert-butylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-tert-butylphenyl)-4-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 159249446
N-(4-dibenzofuran-4-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline
CID 159404463
N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N,4-diphenylaniline
CID 154961695
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59136875
4-N-(4-dibenzofuran-2-ylphenyl)-4-N-(4-dibenzofuran-4-ylphenyl)-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 58510699
N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline
CID 58113345
3-dibenzofuran-4-yl-N,N-bis[4-(4-phenylphenyl)phenyl]aniline
CID 59136968
N-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-6-phenyldibenzofuran-4-amine
CID 167397842
N,N-bis(4-dibenzofuran-4-ylphenyl)-4-(3-phenylphenyl)aniline;N,N-bis(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline
CID 157477199

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline?
The IUPAC name of N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline (CID 122413267) is N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline.
What is the SMILES notation for N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline?
The canonical SMILES for N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline is CC(C)(C)N(c1ccc(-c2ccccc2)cc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline?
The InChIKey is KKJBOHKVFCDZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H29NO/c1-34(2,3)35(27-20-16-25(17-21-27)24-10-5-4-6-11-24)28-22-18-26(19-23-28)29-13-9-14-31-30-12-7-8-15-32(30)36-33(29)31/h4-23H,1-3H3.
What are the key properties of N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline?
N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline has a molecular weight of 467.61 g/mol, XLogP of 9.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline is sourced from PubChem (CID 122413267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).