N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine

C53H33NO2 — CID 164730958

IUPACN-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)-c3c(ccc5ccccc35)C43c4ccccc4Oc4ccccc43)c3ccc4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C53H33NO2/c1-2-12-34(13-3-1)35-22-25-37(26-23-35)54(39-28-31-49-42(32-39)41-16-6-9-19-48(41)55-49)38-27-30-44-43(33-38)52-40-15-5-4-14-36(40)24-29-47(52)53(44)45-17-7-10-20-50(45)56-51-21-11-8-18-46(51)53/h1-33H
InChIKeyAGCFTSVCMXLLPE-UHFFFAOYSA-N
MW715.85 g/mol
LogP14.34
Rot. Bonds4

About N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine

N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine (PubChem CID 164730958) has the molecular formula C53H33NO2 and a molecular weight of 715.85 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine
PubChem CID164730958
Molecular FormulaC53H33NO2
Molecular Weight715.85 g/mol
Exact Mass715.25
IUPAC NameN-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)-c3c(ccc5ccccc35)C43c4ccccc4Oc4ccccc43)c3ccc4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C53H33NO2/c1-2-12-34(13-3-1)35-22-25-37(26-23-35)54(39-28-31-49-42(32-39)41-16-6-9-19-48(41)55-49)38-27-30-44-43(33-38)52-40-15-5-4-14-36(40)24-29-47(52)53(44)45-17-7-10-20-50(45)56-51-21-11-8-18-46(51)53/h1-33H
InChIKeyAGCFTSVCMXLLPE-UHFFFAOYSA-N
XLogP14.34
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.85
LogP ≤ 514.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-xanthene]-9-amine
CID 164730810
N-(4-dibenzofuran-4-ylphenyl)-N-(2-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine
CID 164730828
N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-2-ylspiro[benzo[g]fluorene-7,9'-xanthene]-9-amine
CID 138476405
N-phenyl-N-(4-phenylphenyl)-8-spiro[benzo[g]fluorene-7,9'-fluorene]-9-yldibenzofuran-2-amine
CID 135299719
N-dibenzofuran-3-yl-N-(4-phenylphenyl)spiro[fluorene-9,9'-xanthene]-3'-amine
CID 174232918
N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)spiro[benzo[g]fluorene-7,9'-xanthene]-9-amine
CID 164730839
N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine
CID 130463127
N-(4-phenanthren-9-ylphenyl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-xanthene]-9-amine
CID 156563259
4-(3'-dibenzofuran-2-yl-9,9'-spirobi[xanthene]-3-yl)-N,N-diphenylaniline
CID 118698577
N-(4-dibenzofuran-2-ylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-3-amine
CID 126538337
N-(4-phenylphenyl)-N-spiro[benzo[g]fluorene-7,9'-thioxanthene]-9-yldibenzofuran-3-amine
CID 156563659
N-dibenzofuran-3-yl-N-phenylspiro[fluoreno[4,3-b][1]benzofuran-7,9'-xanthene]-3-amine
CID 162771437

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine?
The IUPAC name of N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine (CID 164730958) is N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine.
What is the SMILES notation for N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine?
The canonical SMILES for N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)-c3c(ccc5ccccc35)C43c4ccccc4Oc4ccccc43)c3ccc4oc5ccccc5c4c3)cc2)cc1.
What is the InChIKey of N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine?
The InChIKey is AGCFTSVCMXLLPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33NO2/c1-2-12-34(13-3-1)35-22-25-37(26-23-35)54(39-28-31-49-42(32-39)41-16-6-9-19-48(41)55-49)38-27-30-44-43(33-38)52-40-15-5-4-14-36(40)24-29-47(52)53(44)45-17-7-10-20-50(45)56-51-21-11-8-18-46(51)53/h1-33H.
What are the key properties of N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine?
N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine has a molecular weight of 715.85 g/mol, XLogP of 14.34, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-xanthene]-10-amine is sourced from PubChem (CID 164730958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).