ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine

C7H15N3O2 — CID 169237343

IUPACethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine
SMILESCC.CNc1nc(COC)no1
InChIInChI=1S/C5H9N3O2.C2H6/c1-6-5-7-4(3-9-2)8-10-5;1-2/h3H2,1-2H3,(H,6,7,8);1-2H3
InChIKeyWAYRUSJPXCHORJ-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.28
Rot. Bonds3

About ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine

ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine (PubChem CID 169237343) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound Nameethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine
PubChem CID169237343
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Nameethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine
SMILESCC.CNc1nc(COC)no1
InChIInChI=1S/C5H9N3O2.C2H6/c1-6-5-7-4(3-9-2)8-10-5;1-2/h3H2,1-2H3,(H,6,7,8);1-2H3
InChIKeyWAYRUSJPXCHORJ-UHFFFAOYSA-N
XLogP1.28
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine?
The IUPAC name of ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine (CID 169237343) is ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine?
The canonical SMILES for ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine is CC.CNc1nc(COC)no1.
What is the InChIKey of ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine?
The InChIKey is WAYRUSJPXCHORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2.C2H6/c1-6-5-7-4(3-9-2)8-10-5;1-2/h3H2,1-2H3,(H,6,7,8);1-2H3.
What are the key properties of ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine?
ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine has a molecular weight of 173.22 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(methoxymethyl)-N-methyl-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 169237343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).