2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline

C16H10F3NO — CID 154715141

IUPAC2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline
SMILESFC(F)(F)c1cnc2c(c1)-c1oc3ccccc3c1CC2
InChIInChI=1S/C16H10F3NO/c17-16(18,19)9-7-12-13(20-8-9)6-5-11-10-3-1-2-4-14(10)21-15(11)12/h1-4,7-8H,5-6H2
InChIKeyKIAROZMEOJGPPI-UHFFFAOYSA-N
MW289.26 g/mol
LogP4.61
Rot. Bonds

About 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline

2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline (PubChem CID 154715141) has the molecular formula C16H10F3NO and a molecular weight of 289.26 g/mol. Its IUPAC name is 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline.

Molecular Properties

Compound Name2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline
PubChem CID154715141
Molecular FormulaC16H10F3NO
Molecular Weight289.26 g/mol
Exact Mass289.07
IUPAC Name2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline
SMILESFC(F)(F)c1cnc2c(c1)-c1oc3ccccc3c1CC2
InChIInChI=1S/C16H10F3NO/c17-16(18,19)9-7-12-13(20-8-9)6-5-11-10-3-1-2-4-14(10)21-15(11)12/h1-4,7-8H,5-6H2
InChIKeyKIAROZMEOJGPPI-UHFFFAOYSA-N
XLogP4.61
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.26
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(-)-Dimethyl-{2-[3-((R)-1-pyridin-2-yl-ethyl)-benzofuran-2-yl]-ethyl}-amine
CID 44247935
3-(Benzofuran-2-ylmethylene)anabaseine
CID 10338609
N-Dibenzofuran-3-yl-nicotinamide
CID 644729
N-dibenzo[b,d]furan-3-ylisonicotinamide
CID 2833465
2-Phenylpyrano[2,3-f]quinolin-4-one
CID 122184916
N-dibenzofuran-3-yl-2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 127028963
Ethyl 7-[[3-(trifluoromethyl)phenyl]methoxy]quinoline-3-carboxylate
CID 86296266
Ethyl 7-[[4-(trifluoromethyl)phenyl]methoxy]quinoline-3-carboxylate
CID 86296267
Ethyl 7-[[4-fluoro-3-(trifluoromethyl)phenyl]methoxy]quinoline-3-carboxylate
CID 86296270
Ethyl 7-[[3-fluoro-5-(trifluoromethyl)phenyl]methoxy]quinoline-3-carboxylate
CID 86296271
Ethyl 7-[(3,4-difluorophenyl)methoxy]quinoline-3-carboxylate
CID 86296272
Ethyl 7-[(3,5-difluorophenyl)methoxy]quinoline-3-carboxylate
CID 86296464

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline?
The IUPAC name of 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline (CID 154715141) is 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline.
What is the SMILES notation for 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline?
The canonical SMILES for 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline is FC(F)(F)c1cnc2c(c1)-c1oc3ccccc3c1CC2.
What is the InChIKey of 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline?
The InChIKey is KIAROZMEOJGPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3NO/c17-16(18,19)9-7-12-13(20-8-9)6-5-11-10-3-1-2-4-14(10)21-15(11)12/h1-4,7-8H,5-6H2.
What are the key properties of 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline?
2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline has a molecular weight of 289.26 g/mol, XLogP of 4.61, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-5,6-dihydro-[1]benzofuro[2,3-f]quinoline is sourced from PubChem (CID 154715141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).