N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine

C51H34N2O — CID 162779852

IUPACN-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)c4ccc5c(c4)oc4ccccc45)cc32)cc1
InChIInChI=1S/C51H34N2O/c1-2-14-35(15-3-1)53-47-20-10-7-17-41(47)42-26-23-37(29-48(42)53)52(38-24-27-44-43-18-8-11-21-49(43)54-50(44)30-38)36-22-25-40-39-16-6-9-19-45(39)51(46(40)28-36)31-33-12-4-5-13-34(33)32-51/h1-30H,31-32H2
InChIKeyNVMDXBQNMUXYFF-UHFFFAOYSA-N
MW690.85 g/mol
LogP13.22
Rot. Bonds4

About N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine

N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine (PubChem CID 162779852) has the molecular formula C51H34N2O and a molecular weight of 690.85 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
PubChem CID162779852
Molecular FormulaC51H34N2O
Molecular Weight690.85 g/mol
Exact Mass690.27
IUPAC NameN-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)c4ccc5c(c4)oc4ccccc45)cc32)cc1
InChIInChI=1S/C51H34N2O/c1-2-14-35(15-3-1)53-47-20-10-7-17-41(47)42-26-23-37(29-48(42)53)52(38-24-27-44-43-18-8-11-21-49(43)54-50(44)30-38)36-22-25-40-39-16-6-9-19-45(39)51(46(40)28-36)31-33-12-4-5-13-34(33)32-51/h1-30H,31-32H2
InChIKeyNVMDXBQNMUXYFF-UHFFFAOYSA-N
XLogP13.22
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.85
LogP ≤ 513.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-2-yl-9-phenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-3'-ylphenyl)carbazol-2-amine
CID 162779801
N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
CID 162779800
N-dibenzofuran-3-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-fluorene]-9-ylcarbazol-2-amine
CID 164732009
9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
CID 162779844
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-phenylphenyl)spiro[1,3-dihydroindene-2,9'-fluorene]-2'-amine
CID 162779846
N-dibenzofuran-3-yl-9-phenyl-N-triphenylen-2-ylcarbazol-2-amine
CID 166845763
N-dibenzofuran-2-yl-9-phenyl-N-(4-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-dibenzofuran-3-yl-9-phenyl-N-(4-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-dibenzofuran-4-yl-9-phenyl-N-(4-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
CID 158975502
9-(4-fluorophenyl)-N-(4-phenylphenyl)-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-3-amine
CID 162779812
N,9-diphenyl-N-(5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-yl)carbazol-2-amine
CID 170235145
N-dibenzofuran-3-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-thioxanthene]-9-ylcarbazol-2-amine
CID 164794269
N-dibenzofuran-3-yl-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzofuran-3-amine
CID 168814816
N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-(9-phenylcarbazol-2-yl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 89213188

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
The IUPAC name of N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine (CID 162779852) is N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
The canonical SMILES for N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine is c1ccc(-n2c3ccccc3c3ccc(N(c4ccc5c(c4)C4(Cc6ccccc6C4)c4ccccc4-5)c4ccc5c(c4)oc4ccccc45)cc32)cc1.
What is the InChIKey of N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
The InChIKey is NVMDXBQNMUXYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H34N2O/c1-2-14-35(15-3-1)53-47-20-10-7-17-41(47)42-26-23-37(29-48(42)53)52(38-24-27-44-43-18-8-11-21-49(43)54-50(44)30-38)36-22-25-40-39-16-6-9-19-45(39)51(46(40)28-36)31-33-12-4-5-13-34(33)32-51/h1-30H,31-32H2.
What are the key properties of N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine?
N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine has a molecular weight of 690.85 g/mol, XLogP of 13.22, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine is sourced from PubChem (CID 162779852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).