2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline

C143H98N4 — CID 159960138

IUPAC2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline
SMILESCC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccc6cccnc6c5n4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5n4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccnc4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21
InChIInChI=1S/C51H34N2.C48H33N.C44H31N/c1-51(2)44-16-8-7-13-38(44)39-24-22-37(30-45(39)51)47-40-14-5-6-15-41(40)48(46-26-23-33-19-18-32-12-9-27-52-49(32)50(33)53-46)42-25-21-36(29-43(42)47)35-20-17-31-10-3-4-11-34(31)28-35;1-48(2)42-17-9-8-14-36(42)37-24-22-35(29-43(37)48)46-38-15-6-7-16-39(38)47(45-26-23-31-12-5-10-18-44(31)49-45)40-25-21-34(28-41(40)46)33-20-19-30-11-3-4-13-32(30)27-33;1-44(2)40-16-8-7-13-34(40)35-21-20-32(26-41(35)44)42-36-14-5-6-15-37(36)43(33-12-9-23-45-27-33)38-22-19-31(25-39(38)42)30-18-17-28-10-3-4-11-29(28)24-30/h3-30H,1-2H3;3-29H,1-2H3;3-27H,1-2H3
InChIKeyODFLNXDDUGWJJQ-UHFFFAOYSA-N
MW1872.38 g/mol
LogP38.40
Rot. Bonds9

About 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline

2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline (PubChem CID 159960138) has the molecular formula C143H98N4 and a molecular weight of 1872.38 g/mol. Its IUPAC name is 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline.

Molecular Properties

Compound Name2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline
PubChem CID159960138
Molecular FormulaC143H98N4
Molecular Weight1872.38 g/mol
Exact Mass1870.78
IUPAC Name2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline
SMILESCC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccc6cccnc6c5n4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5n4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccnc4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21
InChIInChI=1S/C51H34N2.C48H33N.C44H31N/c1-51(2)44-16-8-7-13-38(44)39-24-22-37(30-45(39)51)47-40-14-5-6-15-41(40)48(46-26-23-33-19-18-32-12-9-27-52-49(32)50(33)53-46)42-25-21-36(29-43(42)47)35-20-17-31-10-3-4-11-34(31)28-35;1-48(2)42-17-9-8-14-36(42)37-24-22-35(29-43(37)48)46-38-15-6-7-16-39(38)47(45-26-23-31-12-5-10-18-44(31)49-45)40-25-21-34(28-41(40)46)33-20-19-30-11-3-4-13-32(30)27-33;1-44(2)40-16-8-7-13-34(40)35-21-20-32(26-41(35)44)42-36-14-5-6-15-37(36)43(33-12-9-23-45-27-33)38-22-19-31(25-39(38)42)30-18-17-28-10-3-4-11-29(28)24-30/h3-30H,1-2H3;3-29H,1-2H3;3-27H,1-2H3
InChIKeyODFLNXDDUGWJJQ-UHFFFAOYSA-N
XLogP38.40
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms147
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001872.38
LogP ≤ 538.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline with MolForge

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Related Compounds

5-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-yl-7-(4-phenylphenyl)benzo[g]isoquinoline
CID 59183787
5-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-yl-7-phenylbenzo[g]isoquinoline
CID 59183244
2-[10-(9,9-dimethylfluoren-2-yl)-3-methylanthracen-9-yl]quinoline
CID 59195716
9-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]acridine
CID 59195530
2-(9,9-dimethylfluoren-2-yl)-9,10-bis(3-naphthalen-2-ylphenyl)anthracene
CID 143930053
10-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-9-phenylanthracene
CID 58323304
9-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 59195124
9-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene
CID 59195394
10-(9,9-dimethylfluoren-2-yl)-2,9-dinaphthalen-2-ylanthracene;2,10-diphenyl-9-(4-phenylphenyl)anthracene;2,9,10-tris(9,9-dimethylfluoren-2-yl)anthracene
CID 162071769
9,10-bis(4-phenylphenyl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;2-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]-9,10-bis(4-phenylphenyl)anthracene;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-9,10-bis(4-phenylphenyl)anthracene
CID 159520005
9-(9,9-dimethylfluoren-2-yl)-7,12-diphenylnaphtho[2,3-h]quinoline
CID 89342054
9-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-10-naphthalen-2-ylanthracene
CID 20822253

Frequently Asked Questions

What is the IUPAC name of 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline?
The IUPAC name of 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline (CID 159960138) is 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline.
What is the SMILES notation for 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline?
The canonical SMILES for 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline is CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccc6cccnc6c5n4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5n4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccnc4)c4ccc(-c5ccc6ccccc6c5)cc34)cc21.
What is the InChIKey of 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline?
The InChIKey is ODFLNXDDUGWJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H34N2.C48H33N.C44H31N/c1-51(2)44-16-8-7-13-38(44)39-24-22-37(30-45(39)51)47-40-14-5-6-15-41(40)48(46-26-23-33-19-18-32-12-9-27-52-49(32)50(33)53-46)42-25-21-36(29-43(42)47)35-20-17-31-10-3-4-11-34(31)28-35;1-48(2)42-17-9-8-14-36(42)37-24-22-35(29-43(37)48)46-38-15-6-7-16-39(38)47(45-26-23-31-12-5-10-18-44(31)49-45)40-25-21-34(28-41(40)46)33-20-19-30-11-3-4-13-32(30)27-33;1-44(2)40-16-8-7-13-34(40)35-21-20-32(26-41(35)44)42-36-14-5-6-15-37(36)43(33-12-9-23-45-27-33)38-22-19-31(25-39(38)42)30-18-17-28-10-3-4-11-29(28)24-30/h3-30H,1-2H3;3-29H,1-2H3;3-27H,1-2H3.
What are the key properties of 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline?
2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline has a molecular weight of 1872.38 g/mol, XLogP of 38.40, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-1,10-phenanthroline;3-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]pyridine;2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]quinoline is sourced from PubChem (CID 159960138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).