8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine

C54H33NO3 — CID 59470035

IUPAC8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc3oc4ccc(N(c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)cc4c3c2)cc1
InChIInChI=1S/C54H33NO3/c1-4-10-34(11-5-1)37-16-22-49-43(28-37)46-31-40(19-25-52(46)56-49)55(41-20-26-53-47(32-41)44-29-38(17-23-50(44)57-53)35-12-6-2-7-13-35)42-21-27-54-48(33-42)45-30-39(18-24-51(45)58-54)36-14-8-3-9-15-36/h1-33H
InChIKeyMWZCEMKUPNPOGV-UHFFFAOYSA-N
MW743.86 g/mol
LogP15.86
Rot. Bonds6

About 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine

8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine (PubChem CID 59470035) has the molecular formula C54H33NO3 and a molecular weight of 743.86 g/mol. Its IUPAC name is 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine.

Molecular Properties

Compound Name8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine
PubChem CID59470035
Molecular FormulaC54H33NO3
Molecular Weight743.86 g/mol
Exact Mass743.25
IUPAC Name8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc3oc4ccc(N(c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)cc4c3c2)cc1
InChIInChI=1S/C54H33NO3/c1-4-10-34(11-5-1)37-16-22-49-43(28-37)46-31-40(19-25-52(46)56-49)55(41-20-26-53-47(32-41)44-29-38(17-23-50(44)57-53)35-12-6-2-7-13-35)42-21-27-54-48(33-42)45-30-39(18-24-51(45)58-54)36-14-8-3-9-15-36/h1-33H
InChIKeyMWZCEMKUPNPOGV-UHFFFAOYSA-N
XLogP15.86
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500743.86
LogP ≤ 515.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

16-phenyl-N,N-bis[4-(4-phenylphenyl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-amine
CID 171050361
N,16-diphenyl-N-[4-(4-phenylphenyl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-amine
CID 171050312
2-N,8-N-diphenyl-2-N,8-N-bis[4-(N-(4-phenylphenyl)anilino)phenyl]dibenzofuran-2,8-diamine
CID 145264524
N,4-diphenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]aniline;4-phenyl-N,N-bis(4-phenylphenyl)aniline;4-phenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 158000824
N-(4-dibenzofuran-2-ylphenyl)-N-phenyldibenzofuran-2-amine
CID 90350985
N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 118405736
N-[4-[4-[3-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)triphenylen-2-amine
CID 121296581
N-[4-[3-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)triphenylen-2-amine
CID 121296561
N-dibenzofuran-2-yl-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 121325419
3-dibenzofuran-2-yl-N,N-bis(4-phenylphenyl)aniline
CID 121327922
N,16-diphenyl-N-(4-phenylphenyl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-7-amine
CID 171050331
N,N,17-triphenyl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-amine
CID 171049996

Frequently Asked Questions

What is the IUPAC name of 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine?
The IUPAC name of 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine (CID 59470035) is 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine.
What is the SMILES notation for 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine?
The canonical SMILES for 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine is c1ccc(-c2ccc3oc4ccc(N(c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)c5ccc6oc7ccc(-c8ccccc8)cc7c6c5)cc4c3c2)cc1.
What is the InChIKey of 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine?
The InChIKey is MWZCEMKUPNPOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H33NO3/c1-4-10-34(11-5-1)37-16-22-49-43(28-37)46-31-40(19-25-52(46)56-49)55(41-20-26-53-47(32-41)44-29-38(17-23-50(44)57-53)35-12-6-2-7-13-35)42-21-27-54-48(33-42)45-30-39(18-24-51(45)58-54)36-14-8-3-9-15-36/h1-33H.
What are the key properties of 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine?
8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine has a molecular weight of 743.86 g/mol, XLogP of 15.86, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-N,N-bis(8-phenyldibenzofuran-2-yl)dibenzofuran-2-amine is sourced from PubChem (CID 59470035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).