10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine

C54H44N2 — CID 121380931

IUPAC10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2C(c2ccc(-c3cc(-c4ccccc4)cc(-c4ccc(N5c6ccccc6C(C)(C)c6ccccc65)cc4)n3)cc2)c2ccccc21
InChIInChI=1S/C54H44N2/c1-53(2)44-20-10-8-18-42(44)52(43-19-9-11-21-45(43)53)39-28-26-37(27-29-39)48-34-40(36-16-6-5-7-17-36)35-49(55-48)38-30-32-41(33-31-38)56-50-24-14-12-22-46(50)54(3,4)47-23-13-15-25-51(47)56/h5-35,52H,1-4H3
InChIKeySJKZASUMXQJERE-UHFFFAOYSA-N
MW720.96 g/mol
LogP14.01
Rot. Bonds5

About 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine

10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine (PubChem CID 121380931) has the molecular formula C54H44N2 and a molecular weight of 720.96 g/mol. Its IUPAC name is 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine.

Molecular Properties

Compound Name10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine
PubChem CID121380931
Molecular FormulaC54H44N2
Molecular Weight720.96 g/mol
Exact Mass720.35
IUPAC Name10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2C(c2ccc(-c3cc(-c4ccccc4)cc(-c4ccc(N5c6ccccc6C(C)(C)c6ccccc65)cc4)n3)cc2)c2ccccc21
InChIInChI=1S/C54H44N2/c1-53(2)44-20-10-8-18-42(44)52(43-19-9-11-21-45(43)53)39-28-26-37(27-29-39)48-34-40(36-16-6-5-7-17-36)35-49(55-48)38-30-32-41(33-31-38)56-50-24-14-12-22-46(50)54(3,4)47-23-13-15-25-51(47)56/h5-35,52H,1-4H3
InChIKeySJKZASUMXQJERE-UHFFFAOYSA-N
XLogP14.01
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500720.96
LogP ≤ 514.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine with MolForge

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Related Compounds

10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine;10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 157103657
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528441
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528442
9,9-dimethyl-10-[4-[2,6,7-tris(4-phenylphenyl)pyrazino[2,3-b]pyrazin-3-yl]phenyl]acridine
CID 129037640
2-(9,9-dimethylacridin-10-yl)-7-(10,10-dimethyl-9H-anthracen-9-yl)-9,9-dimethyl-10-[4-(1,3,5-triphenylpyrazol-4-yl)phenyl]acridine
CID 138736072
2-[6-(9,9-dimethyl-10-phenylacridin-2-yl)-2-pyridinyl]-9,9-dimethyl-10-phenylacridine
CID 59399596
10-[3-(9,9-dimethylacridin-10-yl)-5-phenylphenyl]-9,9-dimethylacridine
CID 59399603
10-[2-[3-[2-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-5-phenylphenyl]phenyl]-9,9-dimethylacridine
CID 169287507
2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine
CID 118472949
10-(4,6-diphenyl-2-pyridinyl)-9,9-dimethyl-2-naphthalen-2-ylacridine
CID 118472939
2-[7-(2,6-diphenylpyrimidin-4-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-10-phenylacridine
CID 71007179
4-[10-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9,9-dimethylacridin-2-yl]aniline
CID 89183043

Frequently Asked Questions

What is the IUPAC name of 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine?
The IUPAC name of 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine (CID 121380931) is 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine.
What is the SMILES notation for 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine?
The canonical SMILES for 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine is CC1(C)c2ccccc2C(c2ccc(-c3cc(-c4ccccc4)cc(-c4ccc(N5c6ccccc6C(C)(C)c6ccccc65)cc4)n3)cc2)c2ccccc21.
What is the InChIKey of 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine?
The InChIKey is SJKZASUMXQJERE-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H44N2/c1-53(2)44-20-10-8-18-42(44)52(43-19-9-11-21-45(43)53)39-28-26-37(27-29-39)48-34-40(36-16-6-5-7-17-36)35-49(55-48)38-30-32-41(33-31-38)56-50-24-14-12-22-46(50)54(3,4)47-23-13-15-25-51(47)56/h5-35,52H,1-4H3.
What are the key properties of 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine?
10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine has a molecular weight of 720.96 g/mol, XLogP of 14.01, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-[6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-9,9-dimethylacridine is sourced from PubChem (CID 121380931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).