1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol

C14H17NO2S — CID 23870

IUPAC1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol
SMILESOC(CN1CCOCC1)c1csc2ccccc12
InChIInChI=1S/C14H17NO2S/c16-13(9-15-5-7-17-8-6-15)12-10-18-14-4-2-1-3-11(12)14/h1-4,10,13,16H,5-9H2
InChIKeyGDJPFXNCRRFWRR-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.27
Rot. Bonds3

About 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol

1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol (PubChem CID 23870) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol.

Molecular Properties

Compound Name1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol
PubChem CID23870
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol
SMILESOC(CN1CCOCC1)c1csc2ccccc12
InChIInChI=1S/C14H17NO2S/c16-13(9-15-5-7-17-8-6-15)12-10-18-14-4-2-1-3-11(12)14/h1-4,10,13,16H,5-9H2
InChIKeyGDJPFXNCRRFWRR-UHFFFAOYSA-N
XLogP2.27
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Tiemonium Iodide
CID 72142
Tiemonium methosulfate
CID 151420
3-Benzo[b]thiophen-3-yl-1-aza-bicyclo[2.2.2]octan-3-ol
CID 10061123
Benzo(b)thiophene-5-methanol, alpha-((2-(diethylamino)ethoxy)methyl)-, hydrochloride (1:1), (alphaR)-
CID 132522
2-[4-(2-Thienyl)phenyl]-4-methylmorpholin-2-ol
CID 25108103
3-[4-(2-Benzhydryloxy-ethyl)-piperazin-1-yl]-1-thiophen-2-yl-propan-1-ol
CID 44278407
(3R)-3-(1-benzothiophen-2-yl)-1-azabicyclo[2.2.2]octan-3-ol;hydrochloride
CID 45488306
1-(1-benzothiophen-2-yl)-3-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-ol
CID 66572162
1-(1-benzothiophen-3-yl)-3-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-ol
CID 66572393
3-Benzo[b]thiophen-2-yl-1-aza-bicyclo[2.2.2]octan-3-ol
CID 10467755
1-(1-Benzothiophen-3-yl)-2-(dibenzylamino)ethan-1-ol--hydrogen chloride (1/1)
CID 23802
Thieno(3,2-c)pyridine, 4,5,6,7-tetrahydro-5-(2-hydroxy-2-phenylethyl)-, monohydrochloride
CID 3041278

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol?
The IUPAC name of 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol (CID 23870) is 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol.
What is the SMILES notation for 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol?
The canonical SMILES for 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol is OC(CN1CCOCC1)c1csc2ccccc12.
What is the InChIKey of 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol?
The InChIKey is GDJPFXNCRRFWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c16-13(9-15-5-7-17-8-6-15)12-10-18-14-4-2-1-3-11(12)14/h1-4,10,13,16H,5-9H2.
What are the key properties of 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol?
1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol has a molecular weight of 263.36 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol is sourced from PubChem (CID 23870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).