1-(2-phenylpropan-2-yl)acridine

C22H19N — CID 175451537

IUPAC1-(2-phenylpropan-2-yl)acridine
SMILESCC(C)(c1ccccc1)c1cccc2nc3ccccc3cc12
InChIInChI=1S/C22H19N/c1-22(2,17-10-4-3-5-11-17)19-12-8-14-21-18(19)15-16-9-6-7-13-20(16)23-21/h3-15H,1-2H3
InChIKeyGIZCKPKGHAASAN-UHFFFAOYSA-N
MW297.40 g/mol
LogP5.71
Rot. Bonds2

About 1-(2-phenylpropan-2-yl)acridine

1-(2-phenylpropan-2-yl)acridine (PubChem CID 175451537) has the molecular formula C22H19N and a molecular weight of 297.40 g/mol. Its IUPAC name is 1-(2-phenylpropan-2-yl)acridine.

Molecular Properties

Compound Name1-(2-phenylpropan-2-yl)acridine
PubChem CID175451537
Molecular FormulaC22H19N
Molecular Weight297.40 g/mol
Exact Mass297.15
IUPAC Name1-(2-phenylpropan-2-yl)acridine
SMILESCC(C)(c1ccccc1)c1cccc2nc3ccccc3cc12
InChIInChI=1S/C22H19N/c1-22(2,17-10-4-3-5-11-17)19-12-8-14-21-18(19)15-16-9-6-7-13-20(16)23-21/h3-15H,1-2H3
InChIKeyGIZCKPKGHAASAN-UHFFFAOYSA-N
XLogP5.71
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.40
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-benzylacridine;1-(2-phenylpropan-2-yl)acridine
CID 175451536
1-methylacridine;hydrochloride
CID 175333750
2-(2-phenylpropan-2-yl)quinoline
CID 151236236
1-anthracen-1-yl-1-phenylethanol
CID 2793943
acridine;ethane
CID 123684759
2-acridin-1-yl-1-aminohexan-2-ol
CID 22142034
acridine
CID 21226281
1-acridin-1-ylsulfanylacridine
CID 141380741
2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline
CID 140676068
acridine;argon
CID 157415582
acridine;dihydrate
CID 172843020
acridine;methane
CID 21324126

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylpropan-2-yl)acridine?
The IUPAC name of 1-(2-phenylpropan-2-yl)acridine (CID 175451537) is 1-(2-phenylpropan-2-yl)acridine.
What is the SMILES notation for 1-(2-phenylpropan-2-yl)acridine?
The canonical SMILES for 1-(2-phenylpropan-2-yl)acridine is CC(C)(c1ccccc1)c1cccc2nc3ccccc3cc12.
What is the InChIKey of 1-(2-phenylpropan-2-yl)acridine?
The InChIKey is GIZCKPKGHAASAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N/c1-22(2,17-10-4-3-5-11-17)19-12-8-14-21-18(19)15-16-9-6-7-13-20(16)23-21/h3-15H,1-2H3.
What are the key properties of 1-(2-phenylpropan-2-yl)acridine?
1-(2-phenylpropan-2-yl)acridine has a molecular weight of 297.40 g/mol, XLogP of 5.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylpropan-2-yl)acridine is sourced from PubChem (CID 175451537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).