2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol

C7H10N2OS2 — CID 65274075

IUPAC2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol
SMILESOCCSc1nc(C2CC2)ns1
InChIInChI=1S/C7H10N2OS2/c10-3-4-11-7-8-6(9-12-7)5-1-2-5/h5,10H,1-4H2
InChIKeyGZYPPQWXUQITHF-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.50
Rot. Bonds4

About 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol

2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol (PubChem CID 65274075) has the molecular formula C7H10N2OS2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol.

Molecular Properties

Compound Name2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol
PubChem CID65274075
Molecular FormulaC7H10N2OS2
Molecular Weight202.30 g/mol
Exact Mass202.02
IUPAC Name2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol
SMILESOCCSc1nc(C2CC2)ns1
InChIInChI=1S/C7H10N2OS2/c10-3-4-11-7-8-6(9-12-7)5-1-2-5/h5,10H,1-4H2
InChIKeyGZYPPQWXUQITHF-UHFFFAOYSA-N
XLogP1.50
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 65271895
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CID 65274077
CID 65274077
CID 65274078
CID 65274078
CID 65274134
CID 65274134
CID 66103307
CID 66103307
CID 66103976
CID 66103976
CID 66105530
CID 66105530
CID 66105752
CID 66105752
CID 66105754
CID 66105754

Frequently Asked Questions

What is the IUPAC name of 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol?
The IUPAC name of 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol (CID 65274075) is 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol.
What is the SMILES notation for 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol?
The canonical SMILES for 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol is OCCSc1nc(C2CC2)ns1.
What is the InChIKey of 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol?
The InChIKey is GZYPPQWXUQITHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS2/c10-3-4-11-7-8-6(9-12-7)5-1-2-5/h5,10H,1-4H2.
What are the key properties of 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol?
2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol has a molecular weight of 202.30 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanol is sourced from PubChem (CID 65274075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).