(2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol

C11H10N4O2S — CID 104915885

IUPAC(2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol
SMILESN[C@H](CO)c1nc(-c2cnc3ccsc3c2)no1
InChIInChI=1S/C11H10N4O2S/c12-7(5-16)11-14-10(15-17-11)6-3-9-8(13-4-6)1-2-18-9/h1-4,7,16H,5,12H2/t7-/m1/s1
InChIKeyRLHPINLWYKRMGS-SSDOTTSWSA-N
MW262.29 g/mol
LogP1.34
Rot. Bonds3

About (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol

(2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol (PubChem CID 104915885) has the molecular formula C11H10N4O2S and a molecular weight of 262.29 g/mol. Its IUPAC name is (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol
PubChem CID104915885
Molecular FormulaC11H10N4O2S
Molecular Weight262.29 g/mol
Exact Mass262.05
IUPAC Name(2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol
SMILESN[C@H](CO)c1nc(-c2cnc3ccsc3c2)no1
InChIInChI=1S/C11H10N4O2S/c12-7(5-16)11-14-10(15-17-11)6-3-9-8(13-4-6)1-2-18-9/h1-4,7,16H,5,12H2/t7-/m1/s1
InChIKeyRLHPINLWYKRMGS-SSDOTTSWSA-N
XLogP1.34
TPSA98.06 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol?
The IUPAC name of (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol (CID 104915885) is (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol.
What is the SMILES notation for (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol?
The canonical SMILES for (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol is N[C@H](CO)c1nc(-c2cnc3ccsc3c2)no1.
What is the InChIKey of (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol?
The InChIKey is RLHPINLWYKRMGS-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H10N4O2S/c12-7(5-16)11-14-10(15-17-11)6-3-9-8(13-4-6)1-2-18-9/h1-4,7,16H,5,12H2/t7-/m1/s1.
What are the key properties of (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol?
(2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol has a molecular weight of 262.29 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)ethanol is sourced from PubChem (CID 104915885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).