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

C8H15NO — CID 123159258

IUPAC6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine
SMILESCCC1CC(C)=NC(C)O1
InChIInChI=1S/C8H15NO/c1-4-8-5-6(2)9-7(3)10-8/h7-8H,4-5H2,1-3H3
InChIKeyMFGHMJQNEKRBIL-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.99
Rot. Bonds1

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

6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine (PubChem CID 123159258) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine.

Molecular Properties

Compound Name6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine
PubChem CID123159258
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine
SMILESCCC1CC(C)=NC(C)O1
InChIInChI=1S/C8H15NO/c1-4-8-5-6(2)9-7(3)10-8/h7-8H,4-5H2,1-3H3
InChIKeyMFGHMJQNEKRBIL-UHFFFAOYSA-N
XLogP1.99
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine?
The IUPAC name of 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine (CID 123159258) is 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine.
What is the SMILES notation for 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine?
The canonical SMILES for 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine is CCC1CC(C)=NC(C)O1.
What is the InChIKey of 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine?
The InChIKey is MFGHMJQNEKRBIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-8-5-6(2)9-7(3)10-8/h7-8H,4-5H2,1-3H3.
What are the key properties of 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine?
6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine has a molecular weight of 141.21 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine is sourced from PubChem (CID 123159258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).