2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine

C38H23NO — CID 134529300

IUPAC2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)-c3c(oc5ccccc35)C43c4ccccc4-c4ccccc43)cc2)nc1
InChIInChI=1S/C38H23NO/c1-4-12-31-27(9-1)28-10-2-5-13-32(28)38(31)33-21-20-26(24-16-18-25(19-17-24)34-14-7-8-22-39-34)23-30(33)36-29-11-3-6-15-35(29)40-37(36)38/h1-23H
InChIKeyHZRQAUOGZUSYKJ-UHFFFAOYSA-N
MW509.61 g/mol
LogP9.51
Rot. Bonds2

About 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine

2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine (PubChem CID 134529300) has the molecular formula C38H23NO and a molecular weight of 509.61 g/mol. Its IUPAC name is 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine.

Molecular Properties

Compound Name2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine
PubChem CID134529300
Molecular FormulaC38H23NO
Molecular Weight509.61 g/mol
Exact Mass509.18
IUPAC Name2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)-c3c(oc5ccccc35)C43c4ccccc4-c4ccccc43)cc2)nc1
InChIInChI=1S/C38H23NO/c1-4-12-31-27(9-1)28-10-2-5-13-32(28)38(31)33-21-20-26(24-16-18-25(19-17-24)34-14-7-8-22-39-34)23-30(33)36-29-11-3-6-15-35(29)40-37(36)38/h1-23H
InChIKeyHZRQAUOGZUSYKJ-UHFFFAOYSA-N
XLogP9.51
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.61
LogP ≤ 59.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dipyridin-2-yl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-yl-1,3,5-triazine
CID 134529276
1-(4-phenylphenyl)-2-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-3-ylindole;2-phenyl-4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-10'-ylquinoline;2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine
CID 158360414
2,4-diphenyl-6-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-2-ylphenyl)pyrimidine
CID 129264561
2,4-dinaphthalen-1-yl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylpyrimidine;2,4-dinaphthalen-2-yl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-2-yl-1,3,5-triazine;2,4-dipyridin-2-yl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-yl-1,3,5-triazine
CID 159159441
2,4-dinaphthalen-1-yl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylpyrimidine
CID 154619089
2-phenyl-4-(4-phenylphenyl)-6-(3-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-8'-ylphenyl)pyrimidine
CID 134529254
4-phenyl-2-(4-phenylphenyl)-6-(3-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-10'-ylphenyl)pyrimidine;4-phenyl-2-(4-phenylphenyl)-6-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-8'-ylphenyl)pyrimidine;4-phenyl-2-(4-phenylphenyl)-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-3-ylpyrimidine
CID 161342910
4-naphthalen-1-yl-2-phenyl-6-(3-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyrimidine;4-naphthalen-1-yl-6-phenyl-2-(2-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyrimidine;2-naphthalen-1-yl-4-phenyl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylpyrimidine
CID 159671779
2-(9,9-dimethylfluoren-2-yl)-4-naphthalen-1-yl-6-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-yl-1,3,5-triazine
CID 134529294
5-(7-pyridin-2-ylspiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-2-yl)pyrimidine
CID 147794397
2-spiro[fluorene-9,6'-indeno[2,1-b][1]benzothiole]-9'-ylpyridine
CID 134529541
2-phenyl-4-(4-phenylphenyl)-6-(3-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-8'-ylphenyl)pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-(3-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-10'-ylphenyl)pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-10'-ylphenyl)pyrimidine
CID 159409707

Frequently Asked Questions

What is the IUPAC name of 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine?
The IUPAC name of 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine (CID 134529300) is 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine.
What is the SMILES notation for 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine?
The canonical SMILES for 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine is c1ccc(-c2ccc(-c3ccc4c(c3)-c3c(oc5ccccc35)C43c4ccccc4-c4ccccc43)cc2)nc1.
What is the InChIKey of 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine?
The InChIKey is HZRQAUOGZUSYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H23NO/c1-4-12-31-27(9-1)28-10-2-5-13-32(28)38(31)33-21-20-26(24-16-18-25(19-17-24)34-14-7-8-22-39-34)23-30(33)36-29-11-3-6-15-35(29)40-37(36)38/h1-23H.
What are the key properties of 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine?
2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine has a molecular weight of 509.61 g/mol, XLogP of 9.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-spiro[fluorene-9,6'-indeno[2,1-b][1]benzofuran]-9'-ylphenyl)pyridine is sourced from PubChem (CID 134529300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).