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

C7H12ClN3O2 — CID 71758668

IUPAC2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride
SMILESCc1nc(C2CNCCO2)no1.Cl
InChIInChI=1S/C7H11N3O2.ClH/c1-5-9-7(10-12-5)6-4-8-2-3-11-6;/h6,8H,2-4H2,1H3;1H
InChIKeyADQGKSTZYMOJKJ-UHFFFAOYSA-N
MW205.64 g/mol
LogP0.46
Rot. Bonds1

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

2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride (PubChem CID 71758668) has the molecular formula C7H12ClN3O2 and a molecular weight of 205.64 g/mol. Its IUPAC name is 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride.

Molecular Properties

Compound Name2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride
PubChem CID71758668
Molecular FormulaC7H12ClN3O2
Molecular Weight205.64 g/mol
Exact Mass205.06
IUPAC Name2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride
SMILESCc1nc(C2CNCCO2)no1.Cl
InChIInChI=1S/C7H11N3O2.ClH/c1-5-9-7(10-12-5)6-4-8-2-3-11-6;/h6,8H,2-4H2,1H3;1H
InChIKeyADQGKSTZYMOJKJ-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

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
The IUPAC name of 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride (CID 71758668) is 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride.
What is the SMILES notation for 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
The canonical SMILES for 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride is Cc1nc(C2CNCCO2)no1.Cl.
What is the InChIKey of 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
The InChIKey is ADQGKSTZYMOJKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2.ClH/c1-5-9-7(10-12-5)6-4-8-2-3-11-6;/h6,8H,2-4H2,1H3;1H.
What are the key properties of 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride?
2-(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 2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine;hydrochloride is sourced from PubChem (CID 71758668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).