5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride

C9H15ClN2O2 — CID 19038137

IUPAC5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride
SMILESCc1cc(OC2CCNCC2)no1.Cl
InChIInChI=1S/C9H14N2O2.ClH/c1-7-6-9(11-13-7)12-8-2-4-10-5-3-8;/h6,8,10H,2-5H2,1H3;1H
InChIKeyZUBUFKDZGRSVSM-UHFFFAOYSA-N
MW218.68 g/mol
LogP1.54
Rot. Bonds2

About 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride

5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride (PubChem CID 19038137) has the molecular formula C9H15ClN2O2 and a molecular weight of 218.68 g/mol. Its IUPAC name is 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride.

Molecular Properties

Compound Name5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride
PubChem CID19038137
Molecular FormulaC9H15ClN2O2
Molecular Weight218.68 g/mol
Exact Mass218.08
IUPAC Name5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride
SMILESCc1cc(OC2CCNCC2)no1.Cl
InChIInChI=1S/C9H14N2O2.ClH/c1-7-6-9(11-13-7)12-8-2-4-10-5-3-8;/h6,8,10H,2-5H2,1H3;1H
InChIKeyZUBUFKDZGRSVSM-UHFFFAOYSA-N
XLogP1.54
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.68
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Methoxy-ethyl)-[3-(3-piperidin-1-yl-propoxy)-isoxazol-5-ylmethyl]-amine
CID 11666530
Trimethyl-[4-[(5-methyl-1,2-oxazol-3-yl)oxy]but-2-ynyl]azanium iodide
CID 44437242
3-[[(2S)-azetidin-2-yl]methoxy]-5-methyl-1,2-oxazole
CID 56949762
N,N-dimethyl-4-[(5-methylisoxazol-3-yl)oxy]but-2-yn-1-amine methiodide
CID 24809738
N,N-dimethyl-4-[(5-methyl-1,2-oxazol-3-yl)oxy]but-2-yn-1-amine
CID 44437227
5-Methyl-3-(4-pyrrolidin-1-ylbut-2-ynoxy)-1,2-oxazole
CID 44437247
5-Methyl-3-[(4-pyrrolidin-1-ylbut-2-yn-1-yl)oxy]isoxazole methiodide
CID 44437249
3-[(1-Fluoropiperidin-4-yl)methoxy]-5-methyl-1,2-oxazole
CID 178018903
3-(1-Methylpiperidin-4-yl)oxy-5-propan-2-yl-1,2-oxazole
CID 19038111
5-Methyl-3-(1-methylpiperidin-4-yl)oxy-1,2-oxazole;hydrochloride
CID 19038122
5-Methyl-3-(1-methylpiperidin-4-yl)oxy-1,2-oxazole
CID 19038123
4-[(5-Methyl-1,2-oxazol-3-yl)oxy]piperidine
CID 19038138

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride?
The IUPAC name of 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride (CID 19038137) is 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride.
What is the SMILES notation for 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride?
The canonical SMILES for 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride is Cc1cc(OC2CCNCC2)no1.Cl.
What is the InChIKey of 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride?
The InChIKey is ZUBUFKDZGRSVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2.ClH/c1-7-6-9(11-13-7)12-8-2-4-10-5-3-8;/h6,8,10H,2-5H2,1H3;1H.
What are the key properties of 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride?
5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride has a molecular weight of 218.68 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-piperidin-4-yloxy-1,2-oxazole;hydrochloride is sourced from PubChem (CID 19038137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).