1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol

C10H14N2OS — CID 130815266

IUPAC1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol
SMILESOC(Cc1cnsn1)C1CC=CCC1
InChIInChI=1S/C10H14N2OS/c13-10(6-9-7-11-14-12-9)8-4-2-1-3-5-8/h1-2,7-8,10,13H,3-6H2
InChIKeyUKTYLYPBEQPONH-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.80
Rot. Bonds3

About 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol

1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol (PubChem CID 130815266) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol.

Molecular Properties

Compound Name1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol
PubChem CID130815266
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol
SMILESOC(Cc1cnsn1)C1CC=CCC1
InChIInChI=1S/C10H14N2OS/c13-10(6-9-7-11-14-12-9)8-4-2-1-3-5-8/h1-2,7-8,10,13H,3-6H2
InChIKeyUKTYLYPBEQPONH-UHFFFAOYSA-N
XLogP1.80
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-pyrrolidin-3-yl-2-(1,2,5-thiadiazol-3-yl)ethanol
CID 164650172
2-(1,2,5-thiadiazol-3-yl)-1-(thiolan-3-yl)ethanol
CID 130815238
2-(1-butan-2-ylpyrazol-3-yl)-1-cyclohex-3-en-1-ylethanol
CID 64784469
(1R,2R)-1,2-di(cyclohex-3-en-1-yl)ethane-1,2-diol
CID 102217580
2-(5-bromo-2-fluorophenyl)-1-cyclohex-3-en-1-ylethanol
CID 65149611
1-cyclohex-3-en-1-yl-4-methylsulfonylbutan-1-ol
CID 65150116
1-(1,3-dioxolan-2-yl)-3-(1,2,5-thiadiazol-3-yl)propan-2-amine
CID 131227529
1-cyclohex-3-en-1-yl-1-hydroxypropan-2-one
CID 130026688
1-cyclohex-3-en-1-yl-4-methoxybutan-1-ol
CID 114852166
1-cyclohex-3-en-1-yl-2-methylprop-2-en-1-ol
CID 79190134
1-(5-methyloxolan-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanamine
CID 131219612
1-cyclohex-3-en-1-yl-3-(1-methylimidazol-2-yl)propan-1-ol
CID 114529132

Frequently Asked Questions

What is the IUPAC name of 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol?
The IUPAC name of 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol (CID 130815266) is 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol.
What is the SMILES notation for 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol?
The canonical SMILES for 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol is OC(Cc1cnsn1)C1CC=CCC1.
What is the InChIKey of 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol?
The InChIKey is UKTYLYPBEQPONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c13-10(6-9-7-11-14-12-9)8-4-2-1-3-5-8/h1-2,7-8,10,13H,3-6H2.
What are the key properties of 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol?
1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol has a molecular weight of 210.30 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohex-3-en-1-yl-2-(1,2,5-thiadiazol-3-yl)ethanol is sourced from PubChem (CID 130815266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).