2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole

C10H17N3OS — CID 65208510

IUPAC2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole
SMILESCc1nnc(OCCC2CCCNC2)s1
InChIInChI=1S/C10H17N3OS/c1-8-12-13-10(15-8)14-6-4-9-3-2-5-11-7-9/h9,11H,2-7H2,1H3
InChIKeyHWLFCAFFWBPSMY-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.62
Rot. Bonds4

About 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole

2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole (PubChem CID 65208510) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole.

Molecular Properties

Compound Name2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole
PubChem CID65208510
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole
SMILESCc1nnc(OCCC2CCCNC2)s1
InChIInChI=1S/C10H17N3OS/c1-8-12-13-10(15-8)14-6-4-9-3-2-5-11-7-9/h9,11H,2-7H2,1H3
InChIKeyHWLFCAFFWBPSMY-UHFFFAOYSA-N
XLogP1.62
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-5-(piperidin-3-ylmethoxy)-1,3,4-thiadiazole
CID 65208455
2-(2-pyrrolidin-3-ylethoxy)-5-(trifluoromethyl)-1,3,4-thiadiazole
CID 114796320
2-methyl-3-[2-[(3R)-piperidin-3-yl]ethoxy]pyrazine
CID 97163244
3-[2-(4-methylphenoxy)ethyl]piperidine
CID 45075559
(3S)-3-(2-methoxyethyl)azepane
CID 97297954
(3R)-3-(2-phenoxyethyl)piperidine
CID 26192392
5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine
CID 97165134
3-(2-piperidin-3-ylethoxy)pyridazine
CID 62483890
1,3-dimethyl-5-(2-piperidin-3-ylethoxy)pyrazole-4-carboxamide
CID 63757545
(3R)-3-[2-(4-iodophenoxy)ethyl]piperidine
CID 86321285
(3R)-3-[2-(2-ethoxyphenoxy)ethyl]piperidine
CID 86321016
2-[2-[(3R)-piperidin-3-yl]ethoxy]pyridine
CID 94409716

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole?
The IUPAC name of 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole (CID 65208510) is 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole.
What is the SMILES notation for 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole?
The canonical SMILES for 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole is Cc1nnc(OCCC2CCCNC2)s1.
What is the InChIKey of 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole?
The InChIKey is HWLFCAFFWBPSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-8-12-13-10(15-8)14-6-4-9-3-2-5-11-7-9/h9,11H,2-7H2,1H3.
What are the key properties of 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole?
2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole has a molecular weight of 227.33 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-piperidin-3-ylethoxy)-1,3,4-thiadiazole is sourced from PubChem (CID 65208510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).