(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine

C9H15NO — CID 6931650

IUPAC(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
SMILESC=CC1=NC(C)(C)C[C@H](C)O1
InChIInChI=1S/C9H15NO/c1-5-8-10-9(3,4)6-7(2)11-8/h5,7H,1,6H2,2-4H3/t7-/m0/s1
InChIKeyJMQHTHXKRALUHF-ZETCQYMHSA-N
MW153.22 g/mol
LogP2.16
Rot. Bonds1

About (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine

(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine (PubChem CID 6931650) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine.

Molecular Properties

Compound Name(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
PubChem CID6931650
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
SMILESC=CC1=NC(C)(C)C[C@H](C)O1
InChIInChI=1S/C9H15NO/c1-5-8-10-9(3,4)6-7(2)11-8/h5,7H,1,6H2,2-4H3/t7-/m0/s1
InChIKeyJMQHTHXKRALUHF-ZETCQYMHSA-N
XLogP2.16
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,6-Dihydro-2-isopropenyl-4,4,6-trimethyl-4H-1,3-oxazine
CID 123484
5,6-Dihydro-4,4,6-trimethyl-2-vinyl-4H-1,3-oxazine
CID 90992
5,6-Dihydro-4,4-dimethyl-2-vinyl-4H-1,3-oxazine
CID 11970480
2-Ethenyl-4,4,5-trimethyl-5,6-dihydro-1,3-oxazine
CID 139831195
(6S)-4,4,6-trimethyl-2-prop-1-en-2-yl-5,6-dihydro-1,3-oxazine
CID 676822
(6R)-4,4,6-trimethyl-2-prop-1-en-2-yl-5,6-dihydro-1,3-oxazine
CID 676823
(6R)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
CID 6931651
4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine
CID 12072156
2-[(E)-but-1-enyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
CID 121224267

Frequently Asked Questions

What is the IUPAC name of (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
The IUPAC name of (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine (CID 6931650) is (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine.
What is the SMILES notation for (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
The canonical SMILES for (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is C=CC1=NC(C)(C)C[C@H](C)O1.
What is the InChIKey of (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
The InChIKey is JMQHTHXKRALUHF-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H15NO/c1-5-8-10-9(3,4)6-7(2)11-8/h5,7H,1,6H2,2-4H3/t7-/m0/s1.
What are the key properties of (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine?
(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine has a molecular weight of 153.22 g/mol, XLogP of 2.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine is sourced from PubChem (CID 6931650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).