5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine

C52H38N2 — CID 59195181

IUPAC5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine
SMILESCN1c2ccccc2N(c2c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c3cc(-c4ccc5ccccc5c4)ccc23)c2ccccc21
InChIInChI=1S/C52H38N2/c1-52(2)43-21-9-8-19-40(43)50-41(20-14-22-44(50)52)49-37-17-6-7-18-38(37)51(54-47-25-12-10-23-45(47)53(3)46-24-11-13-26-48(46)54)39-30-29-36(32-42(39)49)35-28-27-33-15-4-5-16-34(33)31-35/h4-32H,1-3H3
InChIKeyREDJWMXFDMRWLH-UHFFFAOYSA-N
MW690.89 g/mol
LogP14.34
Rot. Bonds3

About 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine

5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine (PubChem CID 59195181) has the molecular formula C52H38N2 and a molecular weight of 690.89 g/mol. Its IUPAC name is 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine.

Molecular Properties

Compound Name5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine
PubChem CID59195181
Molecular FormulaC52H38N2
Molecular Weight690.89 g/mol
Exact Mass690.30
IUPAC Name5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine
SMILESCN1c2ccccc2N(c2c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c3cc(-c4ccc5ccccc5c4)ccc23)c2ccccc21
InChIInChI=1S/C52H38N2/c1-52(2)43-21-9-8-19-40(43)50-41(20-14-22-44(50)52)49-37-17-6-7-18-38(37)51(54-47-25-12-10-23-45(47)53(3)46-24-11-13-26-48(46)54)39-30-29-36(32-42(39)49)35-28-27-33-15-4-5-16-34(33)31-35/h4-32H,1-3H3
InChIKeyREDJWMXFDMRWLH-UHFFFAOYSA-N
XLogP14.34
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.89
LogP ≤ 514.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine
CID 59195797
9-(9,9-dimethylfluoren-4-yl)-2-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 59196441
9-(9,9-dimethylfluoren-4-yl)-10-(2-naphthalen-2-ylphenyl)-2-phenylanthracene
CID 59196370
10-[10-(9,9-dimethylfluoren-4-yl)-3-phenylanthracen-9-yl]phenothiazine
CID 59195940
2-[10-(9,9-dimethylfluoren-4-yl)-3-phenylanthracen-9-yl]-5,10-dimethylphenazine
CID 59194678
2-(9,9-dimethylfluoren-2-yl)-9-(9,9-dimethylfluoren-4-yl)-10-naphthalen-2-ylanthracene
CID 59195049
9-(9,9-dimethylfluoren-4-yl)-10-(4-fluorophenyl)-2-naphthalen-2-ylanthracene
CID 59195494
3-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]perylene
CID 59194702
9-(9,9-dimethylfluoren-4-yl)-2-naphthalen-1-yl-10-(2-naphthalen-2-ylphenyl)anthracene
CID 59194727
5-[3-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]-10-methylphenazine
CID 59195441
9-(9,9-dimethylfluoren-4-yl)-2-naphthalen-2-yl-10-(5,6,7,8-tetrahydronaphthalen-1-yl)anthracene
CID 59195164
10-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-2-ylanthracen-9-yl]-9H-acridine
CID 59196394

Frequently Asked Questions

What is the IUPAC name of 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine?
The IUPAC name of 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine (CID 59195181) is 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine.
What is the SMILES notation for 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine?
The canonical SMILES for 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine is CN1c2ccccc2N(c2c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c3cc(-c4ccc5ccccc5c4)ccc23)c2ccccc21.
What is the InChIKey of 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine?
The InChIKey is REDJWMXFDMRWLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H38N2/c1-52(2)43-21-9-8-19-40(43)50-41(20-14-22-44(50)52)49-37-17-6-7-18-38(37)51(54-47-25-12-10-23-45(47)53(3)46-24-11-13-26-48(46)54)39-30-29-36(32-42(39)49)35-28-27-33-15-4-5-16-34(33)31-35/h4-32H,1-3H3.
What are the key properties of 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine?
5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine has a molecular weight of 690.89 g/mol, XLogP of 14.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine is sourced from PubChem (CID 59195181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).