3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole

C8H13N3O2 — CID 82407232

IUPAC3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole
SMILESCc1nonc1OC1CCCNC1
InChIInChI=1S/C8H13N3O2/c1-6-8(11-13-10-6)12-7-3-2-4-9-5-7/h7,9H,2-5H2,1H3
InChIKeyUWURKJZARWSPAI-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.51
Rot. Bonds2

About 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole

3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole (PubChem CID 82407232) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole.

Molecular Properties

Compound Name3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole
PubChem CID82407232
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole
SMILESCc1nonc1OC1CCCNC1
InChIInChI=1S/C8H13N3O2/c1-6-8(11-13-10-6)12-7-3-2-4-9-5-7/h7,9H,2-5H2,1H3
InChIKeyUWURKJZARWSPAI-UHFFFAOYSA-N
XLogP0.51
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-piperidin-3-yloxyquinoxaline
CID 62373713
4-methyl-3-piperidin-3-yloxy-1,2-benzoxazole
CID 84695601
5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
CID 66247592
ethane;3-methyl-2-piperidin-3-yloxypyridine-4-carbonitrile
CID 144616313
4,6-dimethyl-2-piperidin-3-yloxypyrimidine;hydrochloride
CID 71638406
3-(3,4,5-trimethylphenoxy)piperidine
CID 91468136
2-methyl-5-piperidin-3-yloxypyridine
CID 18712955
2-methyl-6-[(3R)-piperidin-3-yl]oxypyridine
CID 94407048
5-methyl-2-[(3S)-piperidin-3-yl]oxypyridine
CID 66246612
2-[(3S)-piperidin-3-yl]oxypyridin-3-ol
CID 71646411
2-methyl-3-pyrrolidin-3-yloxypyrazine;hydrochloride
CID 71639334
5-bromo-3-methoxy-2-piperidin-3-yloxypyrazine
CID 131278584

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole?
The IUPAC name of 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole (CID 82407232) is 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole.
What is the SMILES notation for 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole?
The canonical SMILES for 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole is Cc1nonc1OC1CCCNC1.
What is the InChIKey of 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole?
The InChIKey is UWURKJZARWSPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-6-8(11-13-10-6)12-7-3-2-4-9-5-7/h7,9H,2-5H2,1H3.
What are the key properties of 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole?
3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole has a molecular weight of 183.21 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-piperidin-3-yloxy-1,2,5-oxadiazole is sourced from PubChem (CID 82407232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).