4-methyl-2,3-dihydro-1,4-oxazine

C5H9NO — CID 18704486

IUPAC4-methyl-2,3-dihydro-1,4-oxazine
SMILESCN1C=COCC1
InChIInChI=1S/C5H9NO/c1-6-2-4-7-5-3-6/h2,4H,3,5H2,1H3
InChIKeyGEGDLANPARTRKE-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.42
Rot. Bonds

About 4-methyl-2,3-dihydro-1,4-oxazine

4-methyl-2,3-dihydro-1,4-oxazine (PubChem CID 18704486) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 4-methyl-2,3-dihydro-1,4-oxazine.

Molecular Properties

Compound Name4-methyl-2,3-dihydro-1,4-oxazine
PubChem CID18704486
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name4-methyl-2,3-dihydro-1,4-oxazine
SMILESCN1C=COCC1
InChIInChI=1S/C5H9NO/c1-6-2-4-7-5-3-6/h2,4H,3,5H2,1H3
InChIKeyGEGDLANPARTRKE-UHFFFAOYSA-N
XLogP0.42
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Dimethylaminoethyl vinyl ether
CID 19240
2-Ethenoxyethyl(trimethyl)azanium
CID 32501
4-Methyl-1,4-oxazine
CID 15331497
4-Ethyl-2,3-dihydro-1,4-oxazine
CID 21270543
4-Ethyl-1,4-oxazine
CID 70658841
N-ethyl oxazole
CID 23317920
2-Fluoro-4-methyl-2,3-dihydro-1,4-oxazine
CID 174964397
[(Z)-2-methoxyethenyl]-trimethylazanium bromide
CID 134986601
3,3-dimethyl-2H-1,3-oxazol-3-ium
CID 18431014
4-Propan-2-yl-2,3-dihydro-1,4-oxazine
CID 20597168
N-ethenyl-N-ethyl-2-methoxyethanamine
CID 20825931
4-Methyl-4-oxido-2,3-dihydro-1,4-oxazin-4-ium
CID 54188308

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,3-dihydro-1,4-oxazine?
The IUPAC name of 4-methyl-2,3-dihydro-1,4-oxazine (CID 18704486) is 4-methyl-2,3-dihydro-1,4-oxazine.
What is the SMILES notation for 4-methyl-2,3-dihydro-1,4-oxazine?
The canonical SMILES for 4-methyl-2,3-dihydro-1,4-oxazine is CN1C=COCC1.
What is the InChIKey of 4-methyl-2,3-dihydro-1,4-oxazine?
The InChIKey is GEGDLANPARTRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c1-6-2-4-7-5-3-6/h2,4H,3,5H2,1H3.
What are the key properties of 4-methyl-2,3-dihydro-1,4-oxazine?
4-methyl-2,3-dihydro-1,4-oxazine has a molecular weight of 99.13 g/mol, XLogP of 0.42, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,3-dihydro-1,4-oxazine is sourced from PubChem (CID 18704486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).