5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine

C6H11NO3 — CID 142565976

IUPAC5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine
SMILESCOCC1CON=C(C)O1
InChIInChI=1S/C6H11NO3/c1-5-7-9-4-6(10-5)3-8-2/h6H,3-4H2,1-2H3
InChIKeySFDPCIAOPSHNTG-UHFFFAOYSA-N
MW145.16 g/mol
LogP0.38
Rot. Bonds2

About 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine

5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine (PubChem CID 142565976) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine.

Molecular Properties

Compound Name5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine
PubChem CID142565976
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine
SMILESCOCC1CON=C(C)O1
InChIInChI=1S/C6H11NO3/c1-5-7-9-4-6(10-5)3-8-2/h6H,3-4H2,1-2H3
InChIKeySFDPCIAOPSHNTG-UHFFFAOYSA-N
XLogP0.38
TPSA40.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine?
The IUPAC name of 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine (CID 142565976) is 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine.
What is the SMILES notation for 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine?
The canonical SMILES for 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine is COCC1CON=C(C)O1.
What is the InChIKey of 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine?
The InChIKey is SFDPCIAOPSHNTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-5-7-9-4-6(10-5)3-8-2/h6H,3-4H2,1-2H3.
What are the key properties of 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine?
5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine has a molecular weight of 145.16 g/mol, XLogP of 0.38, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-3-methyl-5,6-dihydro-1,4,2-dioxazine is sourced from PubChem (CID 142565976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).