2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole

C35H21NO — CID 134529208

IUPAC2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole
SMILESc1ccc2c(c1)CC(c1cccc3c1-c1oc4ccccc4c1C31c3ccccc3-c3ccccc31)=N2
InChIInChI=1S/C35H21NO/c1-7-18-29-21(10-1)20-30(36-29)24-14-9-17-28-32(24)34-33(25-13-4-8-19-31(25)37-34)35(28)26-15-5-2-11-22(26)23-12-3-6-16-27(23)35/h1-19H,20H2
InChIKeyGIOHXFOZWNOZJI-UHFFFAOYSA-N
MW471.56 g/mol
LogP8.45
Rot. Bonds1

About 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole

2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole (PubChem CID 134529208) has the molecular formula C35H21NO and a molecular weight of 471.56 g/mol. Its IUPAC name is 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole.

Molecular Properties

Compound Name2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole
PubChem CID134529208
Molecular FormulaC35H21NO
Molecular Weight471.56 g/mol
Exact Mass471.16
IUPAC Name2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole
SMILESc1ccc2c(c1)CC(c1cccc3c1-c1oc4ccccc4c1C31c3ccccc3-c3ccccc31)=N2
InChIInChI=1S/C35H21NO/c1-7-18-29-21(10-1)20-30(36-29)24-14-9-17-28-32(24)34-33(25-13-4-8-19-31(25)37-34)35(28)26-15-5-2-11-22(26)23-12-3-6-16-27(23)35/h1-19H,20H2
InChIKeyGIOHXFOZWNOZJI-UHFFFAOYSA-N
XLogP8.45
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.56
LogP ≤ 58.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
CID 134551135
4,6-diphenyl-2-(4-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-3'-ylphenyl)pyrimidine;2,4-diphenyl-6-(4-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-ylphenyl)-1,3,5-triazine;4,6-diphenyl-2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-ylpyrimidine
CID 158617039
4-phenyl-6-(3-phenylphenyl)-2-(3-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-ylphenyl)pyrimidine
CID 134529155
4-carbazol-9-yl-N,N-diphenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
CID 134529861
2-naphthalen-2-yl-4-phenyl-6-[2-[(9S)-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4-yl]phenyl]pyrimidine
CID 155048189
1-phenyl-3-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-ylisoquinoline
CID 154619109
7'-[10-(4-phenylphenyl)anthracen-9-yl]spiro[indeno[1,2-b][1]benzofuran-10,5'-indeno[1,2-b]pyridine]
CID 126652975
N-(9,9-dimethylfluoren-2-yl)-10-(3H-indol-2-yl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-5-amine
CID 171754176
2,4-dipyridin-4-yl-6-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-yl-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-(2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-3'-ylphenyl)-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-(3-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-ylphenyl)-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-1,3,5-triazine
CID 162101034
2,4-diphenyl-6-(2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2-ylphenyl)-1,3,5-triazine;4-naphthalen-1-yl-6-phenyl-2-(3-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2-ylphenyl)pyrimidine;4-naphthalen-1-yl-6-phenyl-2-(4-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-ylphenyl)pyrimidine;4-naphthalen-1-yl-6-phenyl-2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-ylpyrimidine;2-naphthalen-1-yl-4-phenyl-6-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-1-yl-1,3,5-triazine
CID 158895403
2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2-yl-1,10-phenanthroline;2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-ylquinoline;2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4-ylquinoxaline
CID 158284755
CID 174027584
CID 174027584

Frequently Asked Questions

What is the IUPAC name of 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole?
The IUPAC name of 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole (CID 134529208) is 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole.
What is the SMILES notation for 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole?
The canonical SMILES for 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole is c1ccc2c(c1)CC(c1cccc3c1-c1oc4ccccc4c1C31c3ccccc3-c3ccccc31)=N2.
What is the InChIKey of 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole?
The InChIKey is GIOHXFOZWNOZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H21NO/c1-7-18-29-21(10-1)20-30(36-29)24-14-9-17-28-32(24)34-33(25-13-4-8-19-31(25)37-34)35(28)26-15-5-2-11-22(26)23-12-3-6-16-27(23)35/h1-19H,20H2.
What are the key properties of 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole?
2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole has a molecular weight of 471.56 g/mol, XLogP of 8.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-yl-3H-indole is sourced from PubChem (CID 134529208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).