2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine

C15H19NO — CID 22754637

IUPAC2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine
SMILESCC1=C(C)C(C)(C)N=C(Cc2ccccc2)O1
InChIInChI=1S/C15H19NO/c1-11-12(2)17-14(16-15(11,3)4)10-13-8-6-5-7-9-13/h5-9H,10H2,1-4H3
InChIKeyXNWDTHSMIGUFJS-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.73
Rot. Bonds2

About 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine

2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine (PubChem CID 22754637) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine.

Molecular Properties

Compound Name2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine
PubChem CID22754637
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine
SMILESCC1=C(C)C(C)(C)N=C(Cc2ccccc2)O1
InChIInChI=1S/C15H19NO/c1-11-12(2)17-14(16-15(11,3)4)10-13-8-6-5-7-9-13/h5-9H,10H2,1-4H3
InChIKeyXNWDTHSMIGUFJS-UHFFFAOYSA-N
XLogP3.73
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine?
The IUPAC name of 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine (CID 22754637) is 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine.
What is the SMILES notation for 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine?
The canonical SMILES for 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine is CC1=C(C)C(C)(C)N=C(Cc2ccccc2)O1.
What is the InChIKey of 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine?
The InChIKey is XNWDTHSMIGUFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-11-12(2)17-14(16-15(11,3)4)10-13-8-6-5-7-9-13/h5-9H,10H2,1-4H3.
What are the key properties of 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine?
2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine has a molecular weight of 229.32 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4,4,5,6-tetramethyl-1,3-oxazine is sourced from PubChem (CID 22754637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).