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

C8H15NO — CID 143399688

IUPAC3,6-dimethyl-4H-oxazine;ethane
SMILESCC.CC1=CCC(C)=NO1
InChIInChI=1S/C6H9NO.C2H6/c1-5-3-4-6(2)8-7-5;1-2/h4H,3H2,1-2H3;1-2H3
InChIKeyUIIGCIYXNBUCFO-UHFFFAOYSA-N
MW141.21 g/mol
LogP2.71
Rot. Bonds

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

3,6-dimethyl-4H-oxazine;ethane (PubChem CID 143399688) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3,6-dimethyl-4H-oxazine;ethane.

Molecular Properties

Compound Name3,6-dimethyl-4H-oxazine;ethane
PubChem CID143399688
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3,6-dimethyl-4H-oxazine;ethane
SMILESCC.CC1=CCC(C)=NO1
InChIInChI=1S/C6H9NO.C2H6/c1-5-3-4-6(2)8-7-5;1-2/h4H,3H2,1-2H3;1-2H3
InChIKeyUIIGCIYXNBUCFO-UHFFFAOYSA-N
XLogP2.71
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 ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5Z)-5-ethylidene-3-methyl-4H-1,2-oxazole
CID 68207955
3,4,6-trimethyl-4H-oxazine
CID 123445894
3-ethyl-4,6-dimethyl-4H-oxazine
CID 142167099
3,6-dimethyl-4H-oxazine
CID 142993482
6-methyl-3-(2-methylpropyl)-4H-oxazine
CID 143219950
ethane;(E)-N-prop-1-en-2-yloxycyclohepta-2,5-dien-1-imine
CID 144718972
6-tert-butyl-3-methyl-4H-oxazine
CID 143053398
(E)-N-prop-1-en-2-yloxycyclohepta-2,5-dien-1-imine
CID 144718973
(E)-N-[(E)-hex-2-en-2-yl]oxy-3-methylbutan-2-imine
CID 178166520

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-4H-oxazine;ethane?
The IUPAC name of 3,6-dimethyl-4H-oxazine;ethane (CID 143399688) is 3,6-dimethyl-4H-oxazine;ethane.
What is the SMILES notation for 3,6-dimethyl-4H-oxazine;ethane?
The canonical SMILES for 3,6-dimethyl-4H-oxazine;ethane is CC.CC1=CCC(C)=NO1.
What is the InChIKey of 3,6-dimethyl-4H-oxazine;ethane?
The InChIKey is UIIGCIYXNBUCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO.C2H6/c1-5-3-4-6(2)8-7-5;1-2/h4H,3H2,1-2H3;1-2H3.
What are the key properties of 3,6-dimethyl-4H-oxazine;ethane?
3,6-dimethyl-4H-oxazine;ethane has a molecular weight of 141.21 g/mol, XLogP of 2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-4H-oxazine;ethane is sourced from PubChem (CID 143399688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).