(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol

C11H17NO2S — CID 79667022

IUPAC(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol
SMILESCCN1CCOC(C(O)c2ccsc2)C1
InChIInChI=1S/C11H17NO2S/c1-2-12-4-5-14-10(7-12)11(13)9-3-6-15-8-9/h3,6,8,10-11,13H,2,4-5,7H2,1H3
InChIKeyBBUULPKROJFJDR-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.50
Rot. Bonds3

About (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol

(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol (PubChem CID 79667022) has the molecular formula C11H17NO2S and a molecular weight of 227.33 g/mol. Its IUPAC name is (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol
PubChem CID79667022
Molecular FormulaC11H17NO2S
Molecular Weight227.33 g/mol
Exact Mass227.10
IUPAC Name(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol
SMILESCCN1CCOC(C(O)c2ccsc2)C1
InChIInChI=1S/C11H17NO2S/c1-2-12-4-5-14-10(7-12)11(13)9-3-6-15-8-9/h3,6,8,10-11,13H,2,4-5,7H2,1H3
InChIKeyBBUULPKROJFJDR-UHFFFAOYSA-N
XLogP1.50
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-ethylmorpholin-2-yl)-2-thiophen-3-ylethanamine
CID 79667283
(1S)-1-[(2R)-4-ethylmorpholin-2-yl]ethane-1,2-diol
CID 177187353
(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol
CID 116543719
oxolan-2-yl(thiophen-3-yl)methanol
CID 65331077
(4-ethylmorpholin-2-yl)-(1-propylpyrazol-4-yl)methanol
CID 79666511
(4-ethylmorpholin-2-yl)-quinolin-6-ylmethanol
CID 81220754
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666603
(4-ethylmorpholin-2-yl)-(5-fluoro-2-methylphenyl)methanol
CID 79666863
(4-ethylmorpholin-2-yl)-(2-ethyl-1,2,4-triazol-3-yl)methanol
CID 112743953
1-(4-ethylmorpholin-2-yl)-2-methylbutan-1-ol
CID 79666860
(4-ethylmorpholin-2-yl)-isoquinolin-4-ylmethanol
CID 79666005
(R)-[(2R)-4-benzylmorpholin-2-yl]-phenylmethanol
CID 58997974

Frequently Asked Questions

What is the IUPAC name of (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol?
The IUPAC name of (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol (CID 79667022) is (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol.
What is the SMILES notation for (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol?
The canonical SMILES for (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol is CCN1CCOC(C(O)c2ccsc2)C1.
What is the InChIKey of (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol?
The InChIKey is BBUULPKROJFJDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2S/c1-2-12-4-5-14-10(7-12)11(13)9-3-6-15-8-9/h3,6,8,10-11,13H,2,4-5,7H2,1H3.
What are the key properties of (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol?
(4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol has a molecular weight of 227.33 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylmorpholin-2-yl)-thiophen-3-ylmethanol is sourced from PubChem (CID 79667022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).