2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine

C47H37N — CID 58880979

IUPAC2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccc6)ccc5-c5ccccn5)ccc3-4)cc21
InChIInChI=1S/C47H37N/c1-46(2)41-15-9-8-14-35(41)36-21-17-32(27-42(36)46)33-18-22-37-38-23-20-34(29-44(38)47(3,4)43(37)28-33)40-26-31(30-12-6-5-7-13-30)19-24-39(40)45-16-10-11-25-48-45/h5-29H,1-4H3
InChIKeyUUUCZUOJEAFUGC-UHFFFAOYSA-N
MW615.82 g/mol
LogP12.36
Rot. Bonds4

About 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine

2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine (PubChem CID 58880979) has the molecular formula C47H37N and a molecular weight of 615.82 g/mol. Its IUPAC name is 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine.

Molecular Properties

Compound Name2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine
PubChem CID58880979
Molecular FormulaC47H37N
Molecular Weight615.82 g/mol
Exact Mass615.29
IUPAC Name2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccc6)ccc5-c5ccccn5)ccc3-4)cc21
InChIInChI=1S/C47H37N/c1-46(2)41-15-9-8-14-35(41)36-21-17-32(27-42(36)46)33-18-22-37-38-23-20-34(29-44(38)47(3,4)43(37)28-33)40-26-31(30-12-6-5-7-13-30)19-24-39(40)45-16-10-11-25-48-45/h5-29H,1-4H3
InChIKeyUUUCZUOJEAFUGC-UHFFFAOYSA-N
XLogP12.36
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500615.82
LogP ≤ 512.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]pyridine
CID 58881047
2-[3-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]pyridine
CID 153423317
2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine
CID 58881166
2-[7-[7-[9,9-dimethyl-2-(4-phenylphenyl)fluoren-3-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]pyrimidine
CID 58880891
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-(2,5-diphenylphenyl)-9,9-dimethylfluorene
CID 58881189
2-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]pyridine
CID 153423472
2-(4-phenyl-2-pyridin-2-ylphenyl)pyridine
CID 142417656
2-[3-(9,9-dimethylfluoren-3-yl)-5-pyridin-2-ylphenyl]-4,6-diphenyl-1,3,5-triazine
CID 129292703
4-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-2-phenyl-6-pyridin-2-ylpyrimidine
CID 168777700
2-[4-[4-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]phenyl]phenyl]-9,9-dimethyl-7-(2-phenylphenyl)fluorene
CID 58880971
2-[3-[3-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]-5-pyridin-2-ylphenyl]pyridine
CID 59195620
2-[4-(9,9-dimethylfluoren-2-yl)-3-phenylphenyl]-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 146187818

Frequently Asked Questions

What is the IUPAC name of 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine?
The IUPAC name of 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine (CID 58880979) is 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine.
What is the SMILES notation for 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine?
The canonical SMILES for 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccc6)ccc5-c5ccccn5)ccc3-4)cc21.
What is the InChIKey of 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine?
The InChIKey is UUUCZUOJEAFUGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H37N/c1-46(2)41-15-9-8-14-35(41)36-21-17-32(27-42(36)46)33-18-22-37-38-23-20-34(29-44(38)47(3,4)43(37)28-33)40-26-31(30-12-6-5-7-13-30)19-24-39(40)45-16-10-11-25-48-45/h5-29H,1-4H3.
What are the key properties of 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine?
2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine has a molecular weight of 615.82 g/mol, XLogP of 12.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4-phenylphenyl]pyridine is sourced from PubChem (CID 58880979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).