2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline

C17H10F3N3 — CID 14207820

IUPAC2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline
SMILESFC(F)(F)c1cccc(-c2nc3c(cnc4ccccc43)[nH]2)c1
InChIInChI=1S/C17H10F3N3/c18-17(19,20)11-5-3-4-10(8-11)16-22-14-9-21-13-7-2-1-6-12(13)15(14)23-16/h1-9H,(H,22,23)
InChIKeyFJIDYVNPZOVPOX-UHFFFAOYSA-N
MW313.28 g/mol
LogP4.80
Rot. Bonds1

About 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline

2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline (PubChem CID 14207820) has the molecular formula C17H10F3N3 and a molecular weight of 313.28 g/mol. Its IUPAC name is 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline
PubChem CID14207820
Molecular FormulaC17H10F3N3
Molecular Weight313.28 g/mol
Exact Mass313.08
IUPAC Name2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline
SMILESFC(F)(F)c1cccc(-c2nc3c(cnc4ccccc43)[nH]2)c1
InChIInChI=1S/C17H10F3N3/c18-17(19,20)11-5-3-4-10(8-11)16-22-14-9-21-13-7-2-1-6-12(13)15(14)23-16/h1-9H,(H,22,23)
InChIKeyFJIDYVNPZOVPOX-UHFFFAOYSA-N
XLogP4.80
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.28
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-pyridin-4-yl-3H-imidazo[4,5-c]quinoline
CID 14207821
5,6-difluoro-2-[3-(trifluoromethyl)phenyl]-1H-benzimidazole
CID 60980278
2-[3-(trifluoromethyl)phenyl]-3H-benzimidazol-5-amine
CID 23085660
2-[3-(trifluoromethyl)phenyl]-1H-benzimidazole-4-carboxamide
CID 10852098
4,5-diiodo-2-[3-(trifluoromethyl)phenyl]-1H-imidazole
CID 67133332
2-(3-fluorophenyl)-6-(trifluoromethyl)-1H-benzimidazole
CID 14957639
3-(3H-imidazo[4,5-c]quinolin-2-ylmethyl)-5-(trifluoromethyl)-1,2-oxazole
CID 126666676
7-bromo-2-(2-phenylphenyl)-3H-imidazo[4,5-c]quinoline
CID 57394267
2-[4-[3-(trifluoromethyl)phenoxy]phenyl]-1H-benzimidazole
CID 68842284
6-amino-2-[3-(trifluoromethyl)phenyl]-3H-quinazolin-4-one
CID 137104076
5-methyl-2-phenyl-4-[3-(trifluoromethyl)phenyl]-1H-imidazole
CID 153289392
N-[3-(1H-benzimidazol-2-yl)phenyl]-3-(trifluoromethyl)benzamide
CID 4124334

Frequently Asked Questions

What is the IUPAC name of 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline (CID 14207820) is 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline is FC(F)(F)c1cccc(-c2nc3c(cnc4ccccc43)[nH]2)c1.
What is the InChIKey of 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline?
The InChIKey is FJIDYVNPZOVPOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F3N3/c18-17(19,20)11-5-3-4-10(8-11)16-22-14-9-21-13-7-2-1-6-12(13)15(14)23-16/h1-9H,(H,22,23).
What are the key properties of 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline?
2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline has a molecular weight of 313.28 g/mol, XLogP of 4.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 14207820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).