4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine

C10H19NO — CID 19862115

IUPAC4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine
SMILESCCCCN1C=C(C)OC(C)C1
InChIInChI=1S/C10H19NO/c1-4-5-6-11-7-9(2)12-10(3)8-11/h7,10H,4-6,8H2,1-3H3
InChIKeyLPFXRPIXVONUBP-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.37
Rot. Bonds3

About 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine

4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine (PubChem CID 19862115) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine.

Molecular Properties

Compound Name4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine
PubChem CID19862115
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine
SMILESCCCCN1C=C(C)OC(C)C1
InChIInChI=1S/C10H19NO/c1-4-5-6-11-7-9(2)12-10(3)8-11/h7,10H,4-6,8H2,1-3H3
InChIKeyLPFXRPIXVONUBP-UHFFFAOYSA-N
XLogP2.37
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine?
The IUPAC name of 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine (CID 19862115) is 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine.
What is the SMILES notation for 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine?
The canonical SMILES for 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine is CCCCN1C=C(C)OC(C)C1.
What is the InChIKey of 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine?
The InChIKey is LPFXRPIXVONUBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-5-6-11-7-9(2)12-10(3)8-11/h7,10H,4-6,8H2,1-3H3.
What are the key properties of 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine?
4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine has a molecular weight of 169.27 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-2,6-dimethyl-2,3-dihydro-1,4-oxazine is sourced from PubChem (CID 19862115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).