2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine

C8H13N3O3 — CID 86276549

IUPAC2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
SMILESCOCc1nc(C2CNCCO2)no1
InChIInChI=1S/C8H13N3O3/c1-12-5-7-10-8(11-14-7)6-4-9-2-3-13-6/h6,9H,2-5H2,1H3
InChIKeyFCLXAYHXCBXNQI-UHFFFAOYSA-N
MW199.21 g/mol
LogP-0.12
Rot. Bonds3

About 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine

2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine (PubChem CID 86276549) has the molecular formula C8H13N3O3 and a molecular weight of 199.21 g/mol. Its IUPAC name is 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine.

Molecular Properties

Compound Name2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
PubChem CID86276549
Molecular FormulaC8H13N3O3
Molecular Weight199.21 g/mol
Exact Mass199.10
IUPAC Name2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
SMILESCOCc1nc(C2CNCCO2)no1
InChIInChI=1S/C8H13N3O3/c1-12-5-7-10-8(11-14-7)6-4-9-2-3-13-6/h6,9H,2-5H2,1H3
InChIKeyFCLXAYHXCBXNQI-UHFFFAOYSA-N
XLogP-0.12
TPSA69.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(phenoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971788
N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine
CID 138059178
2-[5-(2,4,4-trimethylpentyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971802
2-[5-[(2,6-difluorophenyl)methyl]-1,2,4-oxadiazol-3-yl]morpholine
CID 103972068
2-[5-(2-bicyclo[2.2.1]heptanylmethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103972002
2-[5-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl]morpholine
CID 103971859
2-[5-(1-ethylcyclopentyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971782
2-(5-cyclooctyl-1,2,4-oxadiazol-3-yl)morpholine
CID 103972025
2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103972028
2-[5-(1,2-oxazol-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971807
2-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 104630877
(2S)-2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]morpholine
CID 124511228

Frequently Asked Questions

What is the IUPAC name of 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine?
The IUPAC name of 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine (CID 86276549) is 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine.
What is the SMILES notation for 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine?
The canonical SMILES for 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine is COCc1nc(C2CNCCO2)no1.
What is the InChIKey of 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine?
The InChIKey is FCLXAYHXCBXNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O3/c1-12-5-7-10-8(11-14-7)6-4-9-2-3-13-6/h6,9H,2-5H2,1H3.
What are the key properties of 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine?
2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine has a molecular weight of 199.21 g/mol, XLogP of -0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine is sourced from PubChem (CID 86276549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).