N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine

C48H33NO — CID 140919310

IUPACN-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccccc4)cc4c3oc3ccccc34)cc2)cc1
InChIInChI=1S/C48H33NO/c1-4-14-34(15-5-1)36-24-26-39(27-25-36)44-32-41(33-45-43-21-11-13-23-47(43)50-48(44)45)49(40-30-28-37(29-31-40)35-16-6-2-7-17-35)46-22-12-10-20-42(46)38-18-8-3-9-19-38/h1-33H
InChIKeyVDSZBYWOCYXHRA-UHFFFAOYSA-N
MW639.80 g/mol
LogP13.72
Rot. Bonds7

About N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine

N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine (PubChem CID 140919310) has the molecular formula C48H33NO and a molecular weight of 639.80 g/mol. Its IUPAC name is N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine
PubChem CID140919310
Molecular FormulaC48H33NO
Molecular Weight639.80 g/mol
Exact Mass639.26
IUPAC NameN-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccccc4)cc4c3oc3ccccc34)cc2)cc1
InChIInChI=1S/C48H33NO/c1-4-14-34(15-5-1)36-24-26-39(27-25-36)44-32-41(33-45-43-21-11-13-23-47(43)50-48(44)45)49(40-30-28-37(29-31-40)35-16-6-2-7-17-35)46-22-12-10-20-42(46)38-18-8-3-9-19-38/h1-33H
InChIKeyVDSZBYWOCYXHRA-UHFFFAOYSA-N
XLogP13.72
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500639.80
LogP ≤ 513.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 140919522
N-(4-dibenzofuran-4-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 122675345
4-(2-naphthalen-2-yldibenzofuran-4-yl)-N,N-diphenylaniline;2-phenyl-N-[4-(2-phenyldibenzofuran-4-yl)phenyl]-N-(4-phenylphenyl)aniline;N-phenyl-N-[4-(2-phenyldibenzofuran-4-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 161024145
N-(4-bromophenyl)-N-(4-dibenzofuran-4-ylphenyl)-2-phenylaniline
CID 135165693
2-(3-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)aniline
CID 126709649
7-phenyl-N,N-bis(4-phenylphenyl)-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-5-amine
CID 170536147
N-[4-(5-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]-N-(2-phenylphenyl)dibenzofuran-2-amine
CID 170301157
4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine
CID 140919372
9,9-dimethyl-N-[4-(2-phenyldibenzofuran-4-yl)phenyl]-N-(2-phenylphenyl)fluoren-2-amine
CID 140919240
N-[4-[2-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-yl]phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 140919105
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59136875
N-(9H-fluoren-2-yl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine
CID 140919212

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine?
The IUPAC name of N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine (CID 140919310) is N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine.
What is the SMILES notation for N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine?
The canonical SMILES for N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine is c1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccccc4-c4ccccc4)cc4c3oc3ccccc34)cc2)cc1.
What is the InChIKey of N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine?
The InChIKey is VDSZBYWOCYXHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33NO/c1-4-14-34(15-5-1)36-24-26-39(27-25-36)44-32-41(33-45-43-21-11-13-23-47(43)50-48(44)45)49(40-30-28-37(29-31-40)35-16-6-2-7-17-35)46-22-12-10-20-42(46)38-18-8-3-9-19-38/h1-33H.
What are the key properties of N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine?
N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine has a molecular weight of 639.80 g/mol, XLogP of 13.72, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylphenyl)-N,4-bis(4-phenylphenyl)dibenzofuran-2-amine is sourced from PubChem (CID 140919310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).