5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane

C8H17NO — CID 91088359

IUPAC5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane
SMILESCC.CC1=C(C)OCCN1
InChIInChI=1S/C6H11NO.C2H6/c1-5-6(2)8-4-3-7-5;1-2/h7H,3-4H2,1-2H3;1-2H3
InChIKeyCNSWYUCFOCSRJM-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.88
Rot. Bonds

About 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane

5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane (PubChem CID 91088359) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane.

Molecular Properties

Compound Name5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane
PubChem CID91088359
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane
SMILESCC.CC1=C(C)OCCN1
InChIInChI=1S/C6H11NO.C2H6/c1-5-6(2)8-4-3-7-5;1-2/h7H,3-4H2,1-2H3;1-2H3
InChIKeyCNSWYUCFOCSRJM-UHFFFAOYSA-N
XLogP1.88
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane?
The IUPAC name of 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane (CID 91088359) is 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane.
What is the SMILES notation for 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane?
The canonical SMILES for 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane is CC.CC1=C(C)OCCN1.
What is the InChIKey of 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane?
The InChIKey is CNSWYUCFOCSRJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.C2H6/c1-5-6(2)8-4-3-7-5;1-2/h7H,3-4H2,1-2H3;1-2H3.
What are the key properties of 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane?
5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane has a molecular weight of 143.23 g/mol, XLogP of 1.88, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-3,4-dihydro-2H-1,4-oxazine;ethane is sourced from PubChem (CID 91088359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).