3,4-dimethyl-6H-oxazine;ethane

C8H15NO — CID 144672234

IUPAC3,4-dimethyl-6H-oxazine;ethane
SMILESCC.CC1=CCON=C1C
InChIInChI=1S/C6H9NO.C2H6/c1-5-3-4-8-7-6(5)2;1-2/h3H,4H2,1-2H3;1-2H3
InChIKeyGDLMVCDQPZIAJY-UHFFFAOYSA-N
MW141.21 g/mol
LogP2.37
Rot. Bonds

About 3,4-dimethyl-6H-oxazine;ethane

3,4-dimethyl-6H-oxazine;ethane (PubChem CID 144672234) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3,4-dimethyl-6H-oxazine;ethane.

Molecular Properties

Compound Name3,4-dimethyl-6H-oxazine;ethane
PubChem CID144672234
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3,4-dimethyl-6H-oxazine;ethane
SMILESCC.CC1=CCON=C1C
InChIInChI=1S/C6H9NO.C2H6/c1-5-3-4-8-7-6(5)2;1-2/h3H,4H2,1-2H3;1-2H3
InChIKeyGDLMVCDQPZIAJY-UHFFFAOYSA-N
XLogP2.37
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-6H-oxazine;ethane?
The IUPAC name of 3,4-dimethyl-6H-oxazine;ethane (CID 144672234) is 3,4-dimethyl-6H-oxazine;ethane.
What is the SMILES notation for 3,4-dimethyl-6H-oxazine;ethane?
The canonical SMILES for 3,4-dimethyl-6H-oxazine;ethane is CC.CC1=CCON=C1C.
What is the InChIKey of 3,4-dimethyl-6H-oxazine;ethane?
The InChIKey is GDLMVCDQPZIAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO.C2H6/c1-5-3-4-8-7-6(5)2;1-2/h3H,4H2,1-2H3;1-2H3.
What are the key properties of 3,4-dimethyl-6H-oxazine;ethane?
3,4-dimethyl-6H-oxazine;ethane has a molecular weight of 141.21 g/mol, XLogP of 2.37, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-6H-oxazine;ethane is sourced from PubChem (CID 144672234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).