3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride

C7H12ClN3O2 — CID 75480638

IUPAC3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride
SMILESCc1nc(C2COCCN2)no1.Cl
InChIInChI=1S/C7H11N3O2.ClH/c1-5-9-7(10-12-5)6-4-11-3-2-8-6;/h6,8H,2-4H2,1H3;1H
InChIKeyOQRNWDMNCNQFLO-UHFFFAOYSA-N
MW205.64 g/mol
LogP0.46
Rot. Bonds1

About 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride

3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride (PubChem CID 75480638) has the molecular formula C7H12ClN3O2 and a molecular weight of 205.64 g/mol. Its IUPAC name is 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride.

Molecular Properties

Compound Name3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride
PubChem CID75480638
Molecular FormulaC7H12ClN3O2
Molecular Weight205.64 g/mol
Exact Mass205.06
IUPAC Name3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride
SMILESCc1nc(C2COCCN2)no1.Cl
InChIInChI=1S/C7H11N3O2.ClH/c1-5-9-7(10-12-5)6-4-11-3-2-8-6;/h6,8H,2-4H2,1H3;1H
InChIKeyOQRNWDMNCNQFLO-UHFFFAOYSA-N
XLogP0.46
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.64
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
The IUPAC name of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride (CID 75480638) is 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride.
What is the SMILES notation for 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
The canonical SMILES for 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride is Cc1nc(C2COCCN2)no1.Cl.
What is the InChIKey of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
The InChIKey is OQRNWDMNCNQFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2.ClH/c1-5-9-7(10-12-5)6-4-11-3-2-8-6;/h6,8H,2-4H2,1H3;1H.
What are the key properties of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride has a molecular weight of 205.64 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride is sourced from PubChem (CID 75480638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).