9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol

C19H15FN2OS — CID 86689556

IUPAC9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol
SMILESNCCc1ccc(-c2c(O)ccc3ncc4sccc4c23)cc1F
InChIInChI=1S/C19H15FN2OS/c20-14-9-12(2-1-11(14)5-7-21)18-16(23)4-3-15-19(18)13-6-8-24-17(13)10-22-15/h1-4,6,8-10,23H,5,7,21H2
InChIKeySTBBFWMQOZUVGO-UHFFFAOYSA-N
MW338.41 g/mol
LogP4.46
Rot. Bonds3

About 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol

9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol (PubChem CID 86689556) has the molecular formula C19H15FN2OS and a molecular weight of 338.41 g/mol. Its IUPAC name is 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol.

Molecular Properties

Compound Name9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol
PubChem CID86689556
Molecular FormulaC19H15FN2OS
Molecular Weight338.41 g/mol
Exact Mass338.09
IUPAC Name9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol
SMILESNCCc1ccc(-c2c(O)ccc3ncc4sccc4c23)cc1F
InChIInChI=1S/C19H15FN2OS/c20-14-9-12(2-1-11(14)5-7-21)18-16(23)4-3-15-19(18)13-6-8-24-17(13)10-22-15/h1-4,6,8-10,23H,5,7,21H2
InChIKeySTBBFWMQOZUVGO-UHFFFAOYSA-N
XLogP4.46
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Thiophen-3-yl-3-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]quinolin-6-ol
CID 59804022
9-[4-[1-(Dimethylamino)ethyl]phenyl]-6,7-difluorothieno[2,3-c]quinolin-8-ol
CID 67449244
9-[4-[2-(Dimethylamino)ethyl]phenyl]-6,7-difluorothieno[2,3-c]quinolin-8-ol
CID 67449245
2-[2-Fluoro-4-(8-methoxythieno[2,3-c]quinolin-9-yl)phenyl]propan-1-amine
CID 89675846
2-[2-Fluoro-4-(8-methoxy-6-methylthieno[2,3-c]quinolin-9-yl)phenyl]ethanamine
CID 89676082
9-[4-[1-(Dimethylamino)ethyl]phenyl]-6,7-difluorothieno[2,3-c]quinoline-1,8-diol
CID 123194939
9-[4-(Aminomethyl)phenyl]-6-fluoro-8-hydroxythieno[2,3-c]quinolin
CID 123680579
4-Amino-9-[3-fluoro-4-[2-(methylamino)ethyl]phenyl]-6-methylthieno[2,3-c]quinolin-8-ol
CID 123817761
4-(8-hydroxy-4-methylthieno[2,3-c]quinolin-9-yl)-N-(3,3,3-trifluoropropyl)benzenesulfonamide
CID 123831196
9-{3-Fluor-4-[(3-hydroxypyrrolidin-1-yl)methyl]phenyl}-8-hydroxythieno[2,3-c]quinolin
CID 131743028
2-(3-Fluoro-4-hydroxyphenyl)-4-thiazol-2-yl-quinolin-6-ol
CID 135489129
3-[(4-Fluorophenyl)methyl]-7-(1,3-thiazol-2-yl)quinolin-8-ol
CID 136152616

Frequently Asked Questions

What is the IUPAC name of 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol?
The IUPAC name of 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol (CID 86689556) is 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol.
What is the SMILES notation for 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol?
The canonical SMILES for 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol is NCCc1ccc(-c2c(O)ccc3ncc4sccc4c23)cc1F.
What is the InChIKey of 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol?
The InChIKey is STBBFWMQOZUVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2OS/c20-14-9-12(2-1-11(14)5-7-21)18-16(23)4-3-15-19(18)13-6-8-24-17(13)10-22-15/h1-4,6,8-10,23H,5,7,21H2.
What are the key properties of 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol?
9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol has a molecular weight of 338.41 g/mol, XLogP of 4.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(2-aminoethyl)-3-fluorophenyl]thieno[2,3-c]quinolin-8-ol is sourced from PubChem (CID 86689556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).