1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol

C10H17N3OS — CID 80702083

IUPAC1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol
SMILESCCc1nsc(N2CCC(C)(O)CC2)n1
InChIInChI=1S/C10H17N3OS/c1-3-8-11-9(15-12-8)13-6-4-10(2,14)5-7-13/h14H,3-7H2,1-2H3
InChIKeyUDTZYLSHLIHZAN-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.45
Rot. Bonds2

About 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol

1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol (PubChem CID 80702083) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol
PubChem CID80702083
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol
SMILESCCc1nsc(N2CCC(C)(O)CC2)n1
InChIInChI=1S/C10H17N3OS/c1-3-8-11-9(15-12-8)13-6-4-10(2,14)5-7-13/h14H,3-7H2,1-2H3
InChIKeyUDTZYLSHLIHZAN-UHFFFAOYSA-N
XLogP1.45
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-1-(3-propyl-1,2,4-thiadiazol-5-yl)piperidin-4-ol
CID 81114967
4-ethyl-1-(3-ethyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxylic acid
CID 65270367
4-(3-ethyl-1,2,4-thiadiazol-5-yl)-1,4-thiazinane 1,1-dioxide
CID 75425181
4-(3,5-dimethoxyphenyl)-1-(3-ethyl-1,2,4-thiadiazol-5-yl)piperidin-4-ol
CID 133362474
1-[3-(2-methoxyethyl)-1,2,4-thiadiazol-5-yl]-3-methylpyrrolidin-3-ol
CID 133410736
3-ethyl-5-piperazin-1-yl-1,2,4-thiadiazole
CID 53403990
1-(3-amino-1,2,4-thiadiazol-5-yl)-4-methylazepan-4-ol
CID 107408949
3-ethyl-1-(3-ethyl-1,2,4-thiadiazol-5-yl)pyrrolidine-3-carboxylic acid
CID 65270156
3-amino-1-(3-ethyl-1,2,4-thiadiazol-5-yl)pyrrolidine-3-carboxylic acid
CID 107325141
3-ethyl-5-(4-propylpiperazin-1-yl)-1,2,4-thiadiazole
CID 90141837
3-ethyl-5-(3,3,4-trimethylpiperazin-1-yl)-1,2,4-thiadiazole
CID 126823483
1-(3-ethyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxylic acid
CID 65273603

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol?
The IUPAC name of 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol (CID 80702083) is 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol?
The canonical SMILES for 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol is CCc1nsc(N2CCC(C)(O)CC2)n1.
What is the InChIKey of 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol?
The InChIKey is UDTZYLSHLIHZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-3-8-11-9(15-12-8)13-6-4-10(2,14)5-7-13/h14H,3-7H2,1-2H3.
What are the key properties of 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol?
1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol has a molecular weight of 227.33 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-1,2,4-thiadiazol-5-yl)-4-methylpiperidin-4-ol is sourced from PubChem (CID 80702083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).