9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine

C175H108N6O5 — CID 164949941

IUPAC9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)Oc4ccccc4C54c5ccccc5-c5cccc6cccc4c56)c4ccc5ccccc5c4)cc32)cc1.c1ccc(N(c2ccc3c(c2)Oc2ccccc2C32c3ccccc3-c3cccc4cccc2c34)c2ccc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3c2)cc1.c1ccc(N(c2ccc3c(c2)Oc2ccccc2C32c3ccccc3-c3cccc4cccc2c34)c2ccc3c4ccccc4n(-c4cccc5oc6ccccc6c45)c3c2)cc1
InChIInChI=1S/2C59H36N2O2.C57H36N2O/c1-2-17-38(18-3-1)60(39-31-33-43-42-20-5-9-26-50(42)61(52(43)35-39)51-27-14-30-55-58(51)45-21-6-10-28-53(45)62-55)40-32-34-48-56(36-40)63-54-29-11-8-24-47(54)59(48)46-23-7-4-19-41(46)44-22-12-15-37-16-13-25-49(59)57(37)44;1-2-16-38(17-3-1)60(40-28-31-44-43-19-5-9-25-52(43)61(53(44)35-40)39-30-33-55-47(34-39)45-20-6-10-26-54(45)62-55)41-29-32-50-57(36-41)63-56-27-11-8-23-49(56)59(50)48-22-7-4-18-42(48)46-21-12-14-37-15-13-24-51(59)58(37)46;1-2-18-40(19-3-1)59-52-26-10-7-21-45(52)46-32-30-42(35-53(46)59)58(41-29-28-37-14-4-5-15-39(37)34-41)43-31-33-50-55(36-43)60-54-27-11-9-24-49(54)57(50)48-23-8-6-20-44(48)47-22-12-16-38-17-13-25-51(57)56(38)47/h2*1-36H;1-36H
InChIKeyAJSUMYJHFNMKHZ-UHFFFAOYSA-N
MW2374.83 g/mol
LogP46.58
Rot. Bonds12

About 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine

9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine (PubChem CID 164949941) has the molecular formula C175H108N6O5 and a molecular weight of 2374.83 g/mol. Its IUPAC name is 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine.

Molecular Properties

Compound Name9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
PubChem CID164949941
Molecular FormulaC175H108N6O5
Molecular Weight2374.83 g/mol
Exact Mass2372.84
IUPAC Name9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)Oc4ccccc4C54c5ccccc5-c5cccc6cccc4c56)c4ccc5ccccc5c4)cc32)cc1.c1ccc(N(c2ccc3c(c2)Oc2ccccc2C32c3ccccc3-c3cccc4cccc2c34)c2ccc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3c2)cc1.c1ccc(N(c2ccc3c(c2)Oc2ccccc2C32c3ccccc3-c3cccc4cccc2c34)c2ccc3c4ccccc4n(-c4cccc5oc6ccccc6c45)c3c2)cc1
InChIInChI=1S/2C59H36N2O2.C57H36N2O/c1-2-17-38(18-3-1)60(39-31-33-43-42-20-5-9-26-50(42)61(52(43)35-39)51-27-14-30-55-58(51)45-21-6-10-28-53(45)62-55)40-32-34-48-56(36-40)63-54-29-11-8-24-47(54)59(48)46-23-7-4-19-41(46)44-22-12-15-37-16-13-25-49(59)57(37)44;1-2-16-38(17-3-1)60(40-28-31-44-43-19-5-9-25-52(43)61(53(44)35-40)39-30-33-55-47(34-39)45-20-6-10-26-54(45)62-55)41-29-32-50-57(36-41)63-56-27-11-8-23-49(56)59(50)48-22-7-4-18-42(48)46-21-12-14-37-15-13-24-51(59)58(37)46;1-2-18-40(19-3-1)59-52-26-10-7-21-45(52)46-32-30-42(35-53(46)59)58(41-29-28-37-14-4-5-15-39(37)34-41)43-31-33-50-55(36-43)60-54-27-11-9-24-49(54)57(50)48-23-8-6-20-44(48)47-22-12-16-38-17-13-25-51(57)56(38)47/h2*1-36H;1-36H
InChIKeyAJSUMYJHFNMKHZ-UHFFFAOYSA-N
XLogP46.58
TPSA78.48 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds12
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002374.83
LogP ≤ 546.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine with MolForge

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Related Compounds

9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
CID 164793881
N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
CID 164794089
N-dibenzofuran-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-3-amine;9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-3-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-3-amine;9-dibenzofuran-3-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-3-amine
CID 165051170
N-dibenzofuran-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-2-amine;9-dibenzofuran-3-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-9-ylcarbazol-2-amine
CID 165079772
N-dibenzofuran-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-2'-ylcarbazol-2-amine
CID 164794806
9-dibenzofuran-1-yl-N-naphthalen-1-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-naphthalen-1-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-dibenzothiophen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-dibenzothiophen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-dibenzothiophen-3-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
CID 164966921
N-dibenzofuran-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-2'-ylcarbazol-3-amine
CID 164794710
9-dibenzothiophen-3-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
CID 164794838
N-dibenzofuran-3-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-9-ylcarbazol-2-amine
CID 164732009
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-(9,9-dimethylfluoren-3-yl)-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-(9,9-dimethylfluoren-4-yl)-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-(9,9-dimethylfluoren-2-yl)-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine
CID 164955253
9-dibenzofuran-3-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-2-amine
CID 164794803
9-dibenzofuran-1-yl-N-naphthalen-1-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-2'-ylcarbazol-2-amine;N-dibenzothiophen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-2'-ylcarbazol-2-amine;N-dibenzothiophen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-2'-ylcarbazol-2-amine;N-dibenzothiophen-3-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-2'-ylcarbazol-2-amine
CID 165005039

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine?
The IUPAC name of 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine (CID 164949941) is 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine.
What is the SMILES notation for 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine?
The canonical SMILES for 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine is c1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)Oc4ccccc4C54c5ccccc5-c5cccc6cccc4c56)c4ccc5ccccc5c4)cc32)cc1.c1ccc(N(c2ccc3c(c2)Oc2ccccc2C32c3ccccc3-c3cccc4cccc2c34)c2ccc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3c2)cc1.c1ccc(N(c2ccc3c(c2)Oc2ccccc2C32c3ccccc3-c3cccc4cccc2c34)c2ccc3c4ccccc4n(-c4cccc5oc6ccccc6c45)c3c2)cc1.
What is the InChIKey of 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine?
The InChIKey is AJSUMYJHFNMKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C59H36N2O2.C57H36N2O/c1-2-17-38(18-3-1)60(39-31-33-43-42-20-5-9-26-50(42)61(52(43)35-39)51-27-14-30-55-58(51)45-21-6-10-28-53(45)62-55)40-32-34-48-56(36-40)63-54-29-11-8-24-47(54)59(48)46-23-7-4-19-41(46)44-22-12-15-37-16-13-25-49(59)57(37)44;1-2-16-38(17-3-1)60(40-28-31-44-43-19-5-9-25-52(43)61(53(44)35-40)39-30-33-55-47(34-39)45-20-6-10-26-54(45)62-55)41-29-32-50-57(36-41)63-56-27-11-8-23-49(56)59(50)48-22-7-4-18-42(48)46-21-12-14-37-15-13-24-51(59)58(37)46;1-2-18-40(19-3-1)59-52-26-10-7-21-45(52)46-32-30-42(35-53(46)59)58(41-29-28-37-14-4-5-15-39(37)34-41)43-31-33-50-55(36-43)60-54-27-11-9-24-49(54)57(50)48-23-8-6-20-44(48)47-22-12-16-38-17-13-25-51(57)56(38)47/h2*1-36H;1-36H.
What are the key properties of 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine?
9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine has a molecular weight of 2374.83 g/mol, XLogP of 46.58, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-1-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;9-dibenzofuran-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3'-ylcarbazol-2-amine is sourced from PubChem (CID 164949941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).