9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine

C36H33N — CID 134578132

IUPAC9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine
SMILESCC(C)(C)Cc1ccc(C2(c3ccccc3)c3ccccc3N(c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C36H33N/c1-35(2,3)26-27-22-24-29(25-23-27)36(28-14-6-4-7-15-28)31-18-10-12-20-33(31)37(30-16-8-5-9-17-30)34-21-13-11-19-32(34)36/h4-25H,26H2,1-3H3
InChIKeyIZAVZDGYQODCMD-UHFFFAOYSA-N
MW479.67 g/mol
LogP9.44
Rot. Bonds4

About 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine

9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine (PubChem CID 134578132) has the molecular formula C36H33N and a molecular weight of 479.67 g/mol. Its IUPAC name is 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine.

Molecular Properties

Compound Name9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine
PubChem CID134578132
Molecular FormulaC36H33N
Molecular Weight479.67 g/mol
Exact Mass479.26
IUPAC Name9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine
SMILESCC(C)(C)Cc1ccc(C2(c3ccccc3)c3ccccc3N(c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C36H33N/c1-35(2,3)26-27-22-24-29(25-23-27)36(28-14-6-4-7-15-28)31-18-10-12-20-33(31)37(30-16-8-5-9-17-30)34-21-13-11-19-32(34)36/h4-25H,26H2,1-3H3
InChIKeyIZAVZDGYQODCMD-UHFFFAOYSA-N
XLogP9.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.67
LogP ≤ 59.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

10-[4-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine
CID 59399598
10-[4-(9,10-diphenylacridin-9-yl)phenyl]-2,7-dimethyl-9,9-diphenylacridine
CID 135226075
9-methyl-9,10-diphenylacridine
CID 140899029
2-methyl-10-(4-methylphenyl)-9,9-diphenylacridine
CID 58029188
10-[6-(9,9-diphenylacridin-10-yl)-9-ethylcarbazol-3-yl]-9,9-diphenylacridine
CID 59470098
10-[4-[3-[3-[4-(9,9-diphenylacridin-10-yl)phenyl]phenyl]phenyl]phenyl]-9,9-diphenylacridine
CID 59470076
4-(9,9-diphenylacridin-10-yl)benzonitrile
CID 59470082
9-(5-tert-butyl-2-methoxyphenyl)-9,10-diphenylacridine
CID 68542724
9,9-bis(2-methylphenyl)-10-phenylacridine
CID 59470095
9-phenyl-9-(9-phenylcarbazol-3-yl)-10-[4-(9-phenylcarbazol-3-yl)phenyl]acridine
CID 146511276
2,8-bis(2,2-dimethylpropyl)-10-phenylphenoxazine
CID 156573501
9-phenyl-9-(9,9,10-triphenylacridin-2-yl)thioxanthene 10,10-dioxide
CID 140898981

Frequently Asked Questions

What is the IUPAC name of 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine?
The IUPAC name of 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine (CID 134578132) is 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine.
What is the SMILES notation for 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine?
The canonical SMILES for 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine is CC(C)(C)Cc1ccc(C2(c3ccccc3)c3ccccc3N(c3ccccc3)c3ccccc32)cc1.
What is the InChIKey of 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine?
The InChIKey is IZAVZDGYQODCMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H33N/c1-35(2,3)26-27-22-24-29(25-23-27)36(28-14-6-4-7-15-28)31-18-10-12-20-33(31)37(30-16-8-5-9-17-30)34-21-13-11-19-32(34)36/h4-25H,26H2,1-3H3.
What are the key properties of 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine?
9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine has a molecular weight of 479.67 g/mol, XLogP of 9.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(2,2-dimethylpropyl)phenyl]-9,10-diphenylacridine is sourced from PubChem (CID 134578132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).