8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine

C7H13NO2 — CID 15919374

IUPAC8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine
SMILESCC12OCCCN1CCO2
InChIInChI=1S/C7H13NO2/c1-7-8(4-6-10-7)3-2-5-9-7/h2-6H2,1H3
InChIKeyDRGXNPIKGOASMB-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.41
Rot. Bonds

About 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine

8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine (PubChem CID 15919374) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine.

Molecular Properties

Compound Name8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine
PubChem CID15919374
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine
SMILESCC12OCCCN1CCO2
InChIInChI=1S/C7H13NO2/c1-7-8(4-6-10-7)3-2-5-9-7/h2-6H2,1H3
InChIKeyDRGXNPIKGOASMB-UHFFFAOYSA-N
XLogP0.41
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine?
The IUPAC name of 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine (CID 15919374) is 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine.
What is the SMILES notation for 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine?
The canonical SMILES for 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine is CC12OCCCN1CCO2.
What is the InChIKey of 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine?
The InChIKey is DRGXNPIKGOASMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-7-8(4-6-10-7)3-2-5-9-7/h2-6H2,1H3.
What are the key properties of 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine?
8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine has a molecular weight of 143.19 g/mol, XLogP of 0.41, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8a-methyl-3,5,6,7-tetrahydro-2H-[1,3]oxazolo[2,3-b][1,3]oxazine is sourced from PubChem (CID 15919374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).