4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine

C146H99N9 — CID 162175263

IUPAC4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccc(-c5ccccc5)nc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccccn5)cc4)cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccncc5)cc4)cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)n3)c2)cc1
InChIInChI=1S/C52H33N3.C52H35N3.C42H31N3/c1-2-13-34(14-3-1)37-15-12-16-39(31-37)51-54-49(36-26-24-35(25-27-36)48-23-10-11-30-53-48)33-50(55-51)38-28-29-43-42-19-6-9-22-46(42)52(47(43)32-38)44-20-7-4-17-40(44)41-18-5-8-21-45(41)52;1-4-13-36(14-5-1)40-15-12-16-42(33-40)51-54-49(39-25-23-37(24-26-39)38-29-31-53-32-30-38)35-50(55-51)41-27-28-46-45-21-10-11-22-47(45)52(48(46)34-41,43-17-6-2-7-18-43)44-19-8-3-9-20-44;1-42(2)36-19-10-9-18-34(36)35-22-20-31(25-37(35)42)39-26-40(33-21-23-38(43-27-33)29-14-7-4-8-15-29)45-41(44-39)32-17-11-16-30(24-32)28-12-5-3-6-13-28/h1-33H;1-35H;3-27H,1-2H3
InChIKeyZOHSISZAKNATFY-UHFFFAOYSA-N
MW1979.46 g/mol
LogP35.63
Rot. Bonds17

About 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine

4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine (PubChem CID 162175263) has the molecular formula C146H99N9 and a molecular weight of 1979.46 g/mol. Its IUPAC name is 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine.

Molecular Properties

Compound Name4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
PubChem CID162175263
Molecular FormulaC146H99N9
Molecular Weight1979.46 g/mol
Exact Mass1977.80
IUPAC Name4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccc(-c5ccccc5)nc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccccn5)cc4)cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccncc5)cc4)cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)n3)c2)cc1
InChIInChI=1S/C52H33N3.C52H35N3.C42H31N3/c1-2-13-34(14-3-1)37-15-12-16-39(31-37)51-54-49(36-26-24-35(25-27-36)48-23-10-11-30-53-48)33-50(55-51)38-28-29-43-42-19-6-9-22-46(42)52(47(43)32-38)44-20-7-4-17-40(44)41-18-5-8-21-45(41)52;1-4-13-36(14-5-1)40-15-12-16-42(33-40)51-54-49(39-25-23-37(24-26-39)38-29-31-53-32-30-38)35-50(55-51)41-27-28-46-45-21-10-11-22-47(45)52(48(46)34-41,43-17-6-2-7-18-43)44-19-8-3-9-20-44;1-42(2)36-19-10-9-18-34(36)35-22-20-31(25-37(35)42)39-26-40(33-21-23-38(43-27-33)29-14-7-4-8-15-29)45-41(44-39)32-17-11-16-30(24-32)28-12-5-3-6-13-28/h1-33H;1-35H;3-27H,1-2H3
InChIKeyZOHSISZAKNATFY-UHFFFAOYSA-N
XLogP35.63
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds17
Heavy Atoms155
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001979.46
LogP ≤ 535.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine with MolForge

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Related Compounds

4-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenyl-6-(4-pyridin-4-ylphenyl)pyrimidine;4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenyl-6-(4-pyridin-2-ylphenyl)pyrimidine;2-phenyl-4-(6-phenyl-3-pyridinyl)-6-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrimidine
CID 160814646
2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
CID 157262568
4-(11,11-dimethylbenzo[a]fluoren-9-yl)-2-(4-phenylphenyl)-6-(4-pyridin-2-ylphenyl)pyrimidine;4-(7,7-dimethylbenzo[g]fluoren-9-yl)-2-(4-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-dimethylfluoren-3-yl)-2-(4-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(4-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;4-(9,9-diphenylfluoren-3-yl)-2-(4-phenylphenyl)-6-(4-pyridin-2-ylphenyl)pyrimidine;2-(4-phenylphenyl)-4-(6-phenyl-3-pyridinyl)-6-(9,9'-spirobi[fluorene]-3-yl)pyrimidine
CID 162261187
4-phenyl-2-(3-pyridin-2-ylphenyl)-6-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrimidine
CID 167177109
2-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4,6-diphenylpyridine;4-[3-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-(9,9-diphenylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine;2-[4-(9,9-diphenylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine;4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2,6-diphenylpyrimidine;4-[4-(9,9-diphenylfluoren-2-yl)phenyl]-2,6-diphenylpyrimidine
CID 163695786
2,4-bis(3-phenylphenyl)-6-(9-phenyl-9-pyridin-4-ylfluoren-2-yl)pyrimidine;ethane
CID 142385444
2-phenyl-4-(6-phenyl-3-pyridinyl)-6-[3-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]phenyl]pyrimidine
CID 146632584
4-[4-[3-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]phenyl]-2-phenyl-6-(6-phenyl-3-pyridinyl)pyrimidine;4-[4-[3-(7,7-dimethylbenzo[g]fluoren-9-yl)phenyl]phenyl]-2-phenyl-6-(4-pyridin-4-ylphenyl)pyrimidine;4-[4-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-2-phenyl-6-(4-pyridin-2-ylphenyl)pyrimidine
CID 158894060
4-(12,12-dimethylspiro[indeno[1,2-b]fluorene-6,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl)-6-phenyl-2-(6-pyridin-3-yl-3-pyridinyl)pyrimidine
CID 134574324
2-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4-(4-pyridin-3-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
CID 159513755
4-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-(3-naphthalen-1-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;4-(3-naphthalen-1-ylphenyl)-6-(4-pyridin-4-ylphenyl)-2-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
CID 160776229
6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-3-ylphenyl)quinoxaline;6,7-bis(9,9-dimethylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-2-ylphenyl)quinoxaline;6,7-bis(9,9-diphenylfluoren-2-yl)-2-phenyl-3-(4-pyridin-4-ylphenyl)quinoxaline
CID 159360093

Frequently Asked Questions

What is the IUPAC name of 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
The IUPAC name of 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine (CID 162175263) is 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine.
What is the SMILES notation for 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
The canonical SMILES for 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine is CC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccc(-c5ccccc5)nc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccccn5)cc4)cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccncc5)cc4)cc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)n3)c2)cc1.
What is the InChIKey of 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
The InChIKey is ZOHSISZAKNATFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33N3.C52H35N3.C42H31N3/c1-2-13-34(14-3-1)37-15-12-16-39(31-37)51-54-49(36-26-24-35(25-27-36)48-23-10-11-30-53-48)33-50(55-51)38-28-29-43-42-19-6-9-22-46(42)52(47(43)32-38)44-20-7-4-17-40(44)41-18-5-8-21-45(41)52;1-4-13-36(14-5-1)40-15-12-16-42(33-40)51-54-49(39-25-23-37(24-26-39)38-29-31-53-32-30-38)35-50(55-51)41-27-28-46-45-21-10-11-22-47(45)52(48(46)34-41,43-17-6-2-7-18-43)44-19-8-3-9-20-44;1-42(2)36-19-10-9-18-34(36)35-22-20-31(25-37(35)42)39-26-40(33-21-23-38(43-27-33)29-14-7-4-8-15-29)45-41(44-39)32-17-11-16-30(24-32)28-12-5-3-6-13-28/h1-33H;1-35H;3-27H,1-2H3.
What are the key properties of 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine has a molecular weight of 1979.46 g/mol, XLogP of 35.63, 17 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine is sourced from PubChem (CID 162175263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).