2-ethyl-4,4,6-trimethyl-1,3-oxazinane

C9H19NO — CID 14147615

IUPAC2-ethyl-4,4,6-trimethyl-1,3-oxazinane
SMILESCCC1NC(C)(C)CC(C)O1
InChIInChI=1S/C9H19NO/c1-5-8-10-9(3,4)6-7(2)11-8/h7-8,10H,5-6H2,1-4H3
InChIKeyZCQJBLLQRRBNMQ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.90
Rot. Bonds1

About 2-ethyl-4,4,6-trimethyl-1,3-oxazinane

2-ethyl-4,4,6-trimethyl-1,3-oxazinane (PubChem CID 14147615) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-ethyl-4,4,6-trimethyl-1,3-oxazinane.

Molecular Properties

Compound Name2-ethyl-4,4,6-trimethyl-1,3-oxazinane
PubChem CID14147615
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-ethyl-4,4,6-trimethyl-1,3-oxazinane
SMILESCCC1NC(C)(C)CC(C)O1
InChIInChI=1S/C9H19NO/c1-5-8-10-9(3,4)6-7(2)11-8/h7-8,10H,5-6H2,1-4H3
InChIKeyZCQJBLLQRRBNMQ-UHFFFAOYSA-N
XLogP1.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,4,6-trimethyl-1,3-oxazinane?
The IUPAC name of 2-ethyl-4,4,6-trimethyl-1,3-oxazinane (CID 14147615) is 2-ethyl-4,4,6-trimethyl-1,3-oxazinane.
What is the SMILES notation for 2-ethyl-4,4,6-trimethyl-1,3-oxazinane?
The canonical SMILES for 2-ethyl-4,4,6-trimethyl-1,3-oxazinane is CCC1NC(C)(C)CC(C)O1.
What is the InChIKey of 2-ethyl-4,4,6-trimethyl-1,3-oxazinane?
The InChIKey is ZCQJBLLQRRBNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-8-10-9(3,4)6-7(2)11-8/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 2-ethyl-4,4,6-trimethyl-1,3-oxazinane?
2-ethyl-4,4,6-trimethyl-1,3-oxazinane has a molecular weight of 157.26 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,4,6-trimethyl-1,3-oxazinane is sourced from PubChem (CID 14147615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).