3,6-dimethyl-5,6-dihydro-4H-oxazine

C6H11NO — CID 59168896

IUPAC3,6-dimethyl-5,6-dihydro-4H-oxazine
SMILESCC1=NOC(C)CC1
InChIInChI=1S/C6H11NO/c1-5-3-4-6(2)8-7-5/h6H,3-4H2,1-2H3
InChIKeyDMTWYHAFMWJBKC-UHFFFAOYSA-N
MW113.16 g/mol
LogP1.56
Rot. Bonds

About 3,6-dimethyl-5,6-dihydro-4H-oxazine

3,6-dimethyl-5,6-dihydro-4H-oxazine (PubChem CID 59168896) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 3,6-dimethyl-5,6-dihydro-4H-oxazine.

Molecular Properties

Compound Name3,6-dimethyl-5,6-dihydro-4H-oxazine
PubChem CID59168896
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name3,6-dimethyl-5,6-dihydro-4H-oxazine
SMILESCC1=NOC(C)CC1
InChIInChI=1S/C6H11NO/c1-5-3-4-6(2)8-7-5/h6H,3-4H2,1-2H3
InChIKeyDMTWYHAFMWJBKC-UHFFFAOYSA-N
XLogP1.56
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-Dimethyl-4,5-dihydro-1,2-oxazole
CID 12228202
4H-1,2-Oxazine, 5,6-dihydro-3-methyl-
CID 12307804
6-ethyl-3-(trifluoromethyl)-5,6-dihydro-4H-oxazine
CID 20726710
3-methyl-6-(trifluoromethyl)-5,6-dihydro-4H-oxazine
CID 58815448
cyclohexanone O-(sec-butyl) oxime
CID 91826114
Oxa-azabicyclo[2.2.2]octene
CID 129860581
6-(bromomethyl)-3-methyl-5,6-dihydro-4H-oxazine
CID 11159829
6-(iodomethyl)-3-methyl-5,6-dihydro-4H-oxazine
CID 23245808
3-Propyl-4,5-dihydro-1,2-oxazole
CID 11708053
3-ethyl-5,6-dihydro-4H-1,2-oxazine
CID 12719500
3-Methyl-4,5,6,7-tetrahydrooxazepine
CID 12958754
3-Methyl-5-butylisoxazoline
CID 13358884

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-5,6-dihydro-4H-oxazine?
The IUPAC name of 3,6-dimethyl-5,6-dihydro-4H-oxazine (CID 59168896) is 3,6-dimethyl-5,6-dihydro-4H-oxazine.
What is the SMILES notation for 3,6-dimethyl-5,6-dihydro-4H-oxazine?
The canonical SMILES for 3,6-dimethyl-5,6-dihydro-4H-oxazine is CC1=NOC(C)CC1.
What is the InChIKey of 3,6-dimethyl-5,6-dihydro-4H-oxazine?
The InChIKey is DMTWYHAFMWJBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-5-3-4-6(2)8-7-5/h6H,3-4H2,1-2H3.
What are the key properties of 3,6-dimethyl-5,6-dihydro-4H-oxazine?
3,6-dimethyl-5,6-dihydro-4H-oxazine has a molecular weight of 113.16 g/mol, XLogP of 1.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-5,6-dihydro-4H-oxazine is sourced from PubChem (CID 59168896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).