9-[4-(trifluoromethyl)phenyl]acridine

C20H12F3N — CID 134960902

IUPAC9-[4-(trifluoromethyl)phenyl]acridine
SMILESFC(F)(F)c1ccc(-c2c3ccccc3nc3ccccc23)cc1
InChIInChI=1S/C20H12F3N/c21-20(22,23)14-11-9-13(10-12-14)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)19/h1-12H
InChIKeyLUIDJRIOPKXSDY-UHFFFAOYSA-N
MW323.32 g/mol
LogP6.07
Rot. Bonds1

About 9-[4-(trifluoromethyl)phenyl]acridine

9-[4-(trifluoromethyl)phenyl]acridine (PubChem CID 134960902) has the molecular formula C20H12F3N and a molecular weight of 323.32 g/mol. Its IUPAC name is 9-[4-(trifluoromethyl)phenyl]acridine.

Molecular Properties

Compound Name9-[4-(trifluoromethyl)phenyl]acridine
PubChem CID134960902
Molecular FormulaC20H12F3N
Molecular Weight323.32 g/mol
Exact Mass323.09
IUPAC Name9-[4-(trifluoromethyl)phenyl]acridine
SMILESFC(F)(F)c1ccc(-c2c3ccccc3nc3ccccc23)cc1
InChIInChI=1S/C20H12F3N/c21-20(22,23)14-11-9-13(10-12-14)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)19/h1-12H
InChIKeyLUIDJRIOPKXSDY-UHFFFAOYSA-N
XLogP6.07
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.32
LogP ≤ 56.07
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

[2-propan-2-yl-4-[4-(trifluoromethyl)phenyl]quinolin-3-yl]methanol
CID 15125318
2,9-diphenyl-10-[4-[10-[4-(trifluoromethyl)phenyl]anthracen-9-yl]phenyl]anthracene
CID 89025408
1-[3,4-bis[4-(trifluoromethyl)phenyl]isoquinolin-1-yl]-3,4-bis[4-(trifluoromethyl)phenyl]isoquinoline
CID 169227849
9-(4-methoxyphenyl)-10-[4-(trifluoromethyl)phenyl]anthracene
CID 122370617
4-methyl-2-[4-(trifluoromethyl)phenyl]quinoline
CID 59274673
2,3,6-triphenyl-4,5-bis[4-(trifluoromethyl)phenyl]pyridine
CID 102130644
15,20-bis[4-(trifluoromethyl)phenyl]heptacyclo[14.10.2.02,7.08,28.09,14.019,27.021,26]octacosa-1(27),2,4,6,8(28),9,11,13,15,17,19,21,23,25-tetradecaene
CID 122205192
5,10-bis[4-(trifluoromethyl)phenyl]benzo[g]isoquinoline
CID 59183616
9,20-bis[4-(trifluoromethyl)phenyl]octacyclo[13.11.1.12,10.03,8.04,25.019,27.021,26.014,28]octacosa-1(27),2(28),3,5,7,9,11,13,15,17,19,21,23,25-tetradecaene
CID 46177256
(E)-3-[2-cyclopropyl-4-[4-(trifluoromethyl)phenyl]quinolin-3-yl]prop-2-enal
CID 11291558
9-[4-(bromomethyl)phenyl]acridine
CID 10712694
2-methyl-7-[10-[4-(trifluoromethyl)phenyl]anthracen-9-yl]pyrene
CID 167155102

Frequently Asked Questions

What is the IUPAC name of 9-[4-(trifluoromethyl)phenyl]acridine?
The IUPAC name of 9-[4-(trifluoromethyl)phenyl]acridine (CID 134960902) is 9-[4-(trifluoromethyl)phenyl]acridine.
What is the SMILES notation for 9-[4-(trifluoromethyl)phenyl]acridine?
The canonical SMILES for 9-[4-(trifluoromethyl)phenyl]acridine is FC(F)(F)c1ccc(-c2c3ccccc3nc3ccccc23)cc1.
What is the InChIKey of 9-[4-(trifluoromethyl)phenyl]acridine?
The InChIKey is LUIDJRIOPKXSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12F3N/c21-20(22,23)14-11-9-13(10-12-14)19-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)19/h1-12H.
What are the key properties of 9-[4-(trifluoromethyl)phenyl]acridine?
9-[4-(trifluoromethyl)phenyl]acridine has a molecular weight of 323.32 g/mol, XLogP of 6.07, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(trifluoromethyl)phenyl]acridine is sourced from PubChem (CID 134960902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).