1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol

C5H8N2OS — CID 131543122

IUPAC1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol
SMILESCc1nnc(C(C)O)s1
InChIInChI=1S/C5H8N2OS/c1-3(8)5-7-6-4(2)9-5/h3,8H,1-2H3
InChIKeyPZVAKSHOOAQRHN-UHFFFAOYSA-N
MW144.20 g/mol
LogP0.90
Rot. Bonds1

About 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol

1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol (PubChem CID 131543122) has the molecular formula C5H8N2OS and a molecular weight of 144.20 g/mol. Its IUPAC name is 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol
PubChem CID131543122
Molecular FormulaC5H8N2OS
Molecular Weight144.20 g/mol
Exact Mass144.04
IUPAC Name1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol
SMILESCc1nnc(C(C)O)s1
InChIInChI=1S/C5H8N2OS/c1-3(8)5-7-6-4(2)9-5/h3,8H,1-2H3
InChIKeyPZVAKSHOOAQRHN-UHFFFAOYSA-N
XLogP0.90
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol?
The IUPAC name of 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol (CID 131543122) is 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol.
What is the SMILES notation for 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol?
The canonical SMILES for 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol is Cc1nnc(C(C)O)s1.
What is the InChIKey of 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol?
The InChIKey is PZVAKSHOOAQRHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2OS/c1-3(8)5-7-6-4(2)9-5/h3,8H,1-2H3.
What are the key properties of 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol?
1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol has a molecular weight of 144.20 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,3,4-thiadiazol-2-yl)ethanol is sourced from PubChem (CID 131543122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).