N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline

C32H25NO — CID 58113345

IUPACN-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1
InChIInChI=1S/C32H25NO/c1-22-10-16-25(17-11-22)33(26-18-12-23(2)13-19-26)27-20-14-24(15-21-27)28-7-5-8-30-29-6-3-4-9-31(29)34-32(28)30/h3-21H,1-2H3
InChIKeySHLJJHXCQMXFKW-UHFFFAOYSA-N
MW439.56 g/mol
LogP9.34
Rot. Bonds4

About N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline

N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline (PubChem CID 58113345) has the molecular formula C32H25NO and a molecular weight of 439.56 g/mol. Its IUPAC name is N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline.

Molecular Properties

Compound NameN-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline
PubChem CID58113345
Molecular FormulaC32H25NO
Molecular Weight439.56 g/mol
Exact Mass439.19
IUPAC NameN-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1
InChIInChI=1S/C32H25NO/c1-22-10-16-25(17-11-22)33(26-18-12-23(2)13-19-26)27-20-14-24(15-21-27)28-7-5-8-30-29-6-3-4-9-31(29)34-32(28)30/h3-21H,1-2H3
InChIKeySHLJJHXCQMXFKW-UHFFFAOYSA-N
XLogP9.34
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.56
LogP ≤ 59.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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
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
N-[4-[4-(N-(4-dibenzofuran-4-ylphenyl)anilino)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-[4-(N-(4-dibenzofuran-2-ylphenyl)-4-methylanilino)phenyl]phenyl]-4-methylaniline
CID 161468375
3-dibenzofuran-4-yl-N,N-bis[4-[3-(4-methylphenyl)phenyl]phenyl]aniline;3-dibenzofuran-4-yl-N,N-bis[4-[4-(4-methylphenyl)phenyl]phenyl]aniline;3-dibenzofuran-4-yl-N,N-bis[4-(2-phenylphenyl)phenyl]aniline;3-dibenzofuran-4-yl-N,N-bis[4-(3-phenylphenyl)phenyl]aniline
CID 162075230
3-dibenzofuran-2-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-methylphenyl)phenyl]aniline
CID 118428387
N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-(6-methylnaphthalen-1-yl)phenyl]phenyl]-4-phenylaniline
CID 155119877
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-1-yl-N-phenylaniline
CID 162494606
N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-4-(4-ethenylphenyl)aniline
CID 58568876
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,N-bis[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-methylphenyl)aniline;4-(4-bromophenyl)dibenzofuran;9-[4-(4-bromophenyl)phenyl]carbazole
CID 159691144
N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N,4-diphenylaniline
CID 154961695

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline?
The IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline (CID 58113345) is N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline.
What is the SMILES notation for N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline?
The canonical SMILES for N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline is Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1.
What is the InChIKey of N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline?
The InChIKey is SHLJJHXCQMXFKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H25NO/c1-22-10-16-25(17-11-22)33(26-18-12-23(2)13-19-26)27-20-14-24(15-21-27)28-7-5-8-30-29-6-3-4-9-31(29)34-32(28)30/h3-21H,1-2H3.
What are the key properties of N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline?
N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline has a molecular weight of 439.56 g/mol, XLogP of 9.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-4-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline is sourced from PubChem (CID 58113345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).