4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine

C52H34N2O — CID 176609043

IUPAC4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine
SMILESc1ccc(N(c2cccc(-c3ccc4ccccc4c3)c2)c2ccc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3oc4ccccc4c23)cc1
InChIInChI=1S/C52H34N2O/c1-2-18-40(19-3-1)53(41-20-12-16-37(33-41)38-29-28-35-14-4-5-15-36(35)32-38)49-31-30-43(52-51(49)46-24-8-11-27-50(46)55-52)39-17-13-21-42(34-39)54-47-25-9-6-22-44(47)45-23-7-10-26-48(45)54/h1-34H
InChIKeyRUABMWDDNLQPSW-UHFFFAOYSA-N
MW702.86 g/mol
LogP14.64
Rot. Bonds6

About 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine

4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine (PubChem CID 176609043) has the molecular formula C52H34N2O and a molecular weight of 702.86 g/mol. Its IUPAC name is 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine.

Molecular Properties

Compound Name4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine
PubChem CID176609043
Molecular FormulaC52H34N2O
Molecular Weight702.86 g/mol
Exact Mass702.27
IUPAC Name4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine
SMILESc1ccc(N(c2cccc(-c3ccc4ccccc4c3)c2)c2ccc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3oc4ccccc4c23)cc1
InChIInChI=1S/C52H34N2O/c1-2-18-40(19-3-1)53(41-20-12-16-37(33-41)38-29-28-35-14-4-5-15-36(35)32-38)49-31-30-43(52-51(49)46-24-8-11-27-50(46)55-52)39-17-13-21-42(34-39)54-47-25-9-6-22-44(47)45-23-7-10-26-48(45)54/h1-34H
InChIKeyRUABMWDDNLQPSW-UHFFFAOYSA-N
XLogP14.64
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500702.86
LogP ≤ 514.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-N-naphthalen-2-yldibenzofuran-1-amine
CID 176609302
4-(3-carbazol-9-ylphenyl)-N-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine
CID 176608070
4-(3-carbazol-9-ylphenyl)-N-(3-phenanthren-9-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine
CID 176608189
4-(3-carbazol-9-ylphenyl)-N-(2,6-dimethyl-4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 176608337
4-(4-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-N-naphthalen-2-yldibenzofuran-1-amine
CID 176608048
4-naphthalen-2-yl-N-(3-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069783
N-[4-(4-naphthalen-2-ylphenyl)phenyl]-4-phenyl-N-[4-(9-phenylcarbazol-4-yl)phenyl]dibenzofuran-1-amine
CID 168847677
4-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzofuran-3-amine
CID 176608956
4-(2-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine
CID 176608759
4-(4-carbazol-9-ylphenyl)-N-(3-phenanthren-9-ylphenyl)-N-phenyldibenzofuran-1-amine
CID 176608684
4-(3-carbazol-9-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine
CID 176609708
4-(3-carbazol-9-ylphenyl)-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 176608773

Frequently Asked Questions

What is the IUPAC name of 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine?
The IUPAC name of 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine (CID 176609043) is 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine.
What is the SMILES notation for 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine?
The canonical SMILES for 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine is c1ccc(N(c2cccc(-c3ccc4ccccc4c3)c2)c2ccc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3oc4ccccc4c23)cc1.
What is the InChIKey of 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine?
The InChIKey is RUABMWDDNLQPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34N2O/c1-2-18-40(19-3-1)53(41-20-12-16-37(33-41)38-29-28-35-14-4-5-15-36(35)32-38)49-31-30-43(52-51(49)46-24-8-11-27-50(46)55-52)39-17-13-21-42(34-39)54-47-25-9-6-22-44(47)45-23-7-10-26-48(45)54/h1-34H.
What are the key properties of 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine?
4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine has a molecular weight of 702.86 g/mol, XLogP of 14.64, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-phenyldibenzofuran-1-amine is sourced from PubChem (CID 176609043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).