(3-ethylthiophen-2-yl)-quinolin-8-ylmethanol

C16H15NOS — CID 115826964

IUPAC(3-ethylthiophen-2-yl)-quinolin-8-ylmethanol
SMILESCCc1ccsc1C(O)c1cccc2cccnc12
InChIInChI=1S/C16H15NOS/c1-2-11-8-10-19-16(11)15(18)13-7-3-5-12-6-4-9-17-14(12)13/h3-10,15,18H,2H2,1H3
InChIKeyQWINXXYOAWOZSC-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.94
Rot. Bonds3

About (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol

(3-ethylthiophen-2-yl)-quinolin-8-ylmethanol (PubChem CID 115826964) has the molecular formula C16H15NOS and a molecular weight of 269.37 g/mol. Its IUPAC name is (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol.

Molecular Properties

Compound Name(3-ethylthiophen-2-yl)-quinolin-8-ylmethanol
PubChem CID115826964
Molecular FormulaC16H15NOS
Molecular Weight269.37 g/mol
Exact Mass269.09
IUPAC Name(3-ethylthiophen-2-yl)-quinolin-8-ylmethanol
SMILESCCc1ccsc1C(O)c1cccc2cccnc12
InChIInChI=1S/C16H15NOS/c1-2-11-8-10-19-16(11)15(18)13-7-3-5-12-6-4-9-17-14(12)13/h3-10,15,18H,2H2,1H3
InChIKeyQWINXXYOAWOZSC-UHFFFAOYSA-N
XLogP3.94
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methylthiophen-2-yl)-quinolin-8-ylmethanamine
CID 113230034
(1-ethylimidazol-2-yl)-quinolin-8-ylmethanol
CID 55126409
(3-ethylthiophen-2-yl)-pyrazin-2-ylmethanol
CID 115800270
1-(3-ethylthiophen-2-yl)-2-(3-methyl-2-pyridinyl)ethanol
CID 79976328
2,2-diethoxy-1-quinolin-8-ylethanol
CID 81220226
(2-methylpyrimidin-4-yl)-quinolin-8-ylmethanol
CID 115527954
quinolin-8-yl(1H-1,2,4-triazol-5-yl)methanol
CID 81219926
(2-chloro-3-methylphenyl)-quinolin-8-ylmethanol
CID 115826971
(3-ethylthiophen-2-yl)-(2,3,4-trifluorophenyl)methanol
CID 115797090
(4-methyl-3-pyridinyl)-quinolin-8-ylmethanol
CID 66273941
(3-ethylthiophen-2-yl)-isoquinolin-8-ylmethanamine
CID 103136203
(2-chloro-4,5-dimethylphenyl)-(3-ethylthiophen-2-yl)methanol
CID 115484530

Frequently Asked Questions

What is the IUPAC name of (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol?
The IUPAC name of (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol (CID 115826964) is (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol.
What is the SMILES notation for (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol?
The canonical SMILES for (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol is CCc1ccsc1C(O)c1cccc2cccnc12.
What is the InChIKey of (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol?
The InChIKey is QWINXXYOAWOZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NOS/c1-2-11-8-10-19-16(11)15(18)13-7-3-5-12-6-4-9-17-14(12)13/h3-10,15,18H,2H2,1H3.
What are the key properties of (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol?
(3-ethylthiophen-2-yl)-quinolin-8-ylmethanol has a molecular weight of 269.37 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylthiophen-2-yl)-quinolin-8-ylmethanol is sourced from PubChem (CID 115826964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).