(2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine

C8H15NO — CID 54381164

IUPAC(2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine
SMILESCC1=N[C@@H](C)O[C@@H](C)[C@H]1C
InChIInChI=1S/C8H15NO/c1-5-6(2)9-8(4)10-7(5)3/h5,7-8H,1-4H3/t5-,7-,8+/m0/s1
InChIKeyUZZMPAUMYLQPKV-APQOSEDMSA-N
MW141.21 g/mol
LogP1.85
Rot. Bonds

About (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine

(2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine (PubChem CID 54381164) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine.

Molecular Properties

Compound Name(2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine
PubChem CID54381164
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine
SMILESCC1=N[C@@H](C)O[C@@H](C)[C@H]1C
InChIInChI=1S/C8H15NO/c1-5-6(2)9-8(4)10-7(5)3/h5,7-8H,1-4H3/t5-,7-,8+/m0/s1
InChIKeyUZZMPAUMYLQPKV-APQOSEDMSA-N
XLogP1.85
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,4,6-Tetramethyl-5,6-dihydro-1,3-oxazine
CID 20480852
5-ethyl-2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine
CID 20480853
5-Ethyl-4-methyl-2-(2-methylpropyl)-2,5-dihydro-1,3-oxazole
CID 23467382
4-Ethyl-5-methyl-2-(2-methylpropyl)-2,5-dihydro-1,3-oxazole
CID 23467386
2,4,6,6-Tetramethyl-2,5-dihydro-1,3-oxazine
CID 53857303
2,4,5,6-tetramethyl-5,6-dihydro-4H-1,3-oxazine
CID 54499137
2,4-Dimethyl-2-propan-2-yl-5,6-dihydro-1,3-oxazine
CID 89027412
6-ethyl-2,4-dimethyl-5,6-dihydro-2H-1,3-oxazine
CID 123159258
N-methyl-1-(oxan-4-yl)ethanimine
CID 123881183
4,5,6-trimethyl-5,6-dihydro-2H-1,3-oxazine
CID 146774870
2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine
CID 18719767

Frequently Asked Questions

What is the IUPAC name of (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine?
The IUPAC name of (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine (CID 54381164) is (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine.
What is the SMILES notation for (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine?
The canonical SMILES for (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine is CC1=N[C@@H](C)O[C@@H](C)[C@H]1C.
What is the InChIKey of (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine?
The InChIKey is UZZMPAUMYLQPKV-APQOSEDMSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-6(2)9-8(4)10-7(5)3/h5,7-8H,1-4H3/t5-,7-,8+/m0/s1.
What are the key properties of (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine?
(2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine has a molecular weight of 141.21 g/mol, XLogP of 1.85, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5S,6S)-2,4,5,6-tetramethyl-5,6-dihydro-2H-1,3-oxazine is sourced from PubChem (CID 54381164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).