3-ethyl-4,6-dimethyl-4H-oxazine

C8H13NO — CID 142167099

IUPAC3-ethyl-4,6-dimethyl-4H-oxazine
SMILESCCC1=NOC(C)=CC1C
InChIInChI=1S/C8H13NO/c1-4-8-6(2)5-7(3)10-9-8/h5-6H,4H2,1-3H3
InChIKeyXQWQHPNSVWACIS-UHFFFAOYSA-N
MW139.20 g/mol
LogP2.32
Rot. Bonds1

About 3-ethyl-4,6-dimethyl-4H-oxazine

3-ethyl-4,6-dimethyl-4H-oxazine (PubChem CID 142167099) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 3-ethyl-4,6-dimethyl-4H-oxazine.

Molecular Properties

Compound Name3-ethyl-4,6-dimethyl-4H-oxazine
PubChem CID142167099
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name3-ethyl-4,6-dimethyl-4H-oxazine
SMILESCCC1=NOC(C)=CC1C
InChIInChI=1S/C8H13NO/c1-4-8-6(2)5-7(3)10-9-8/h5-6H,4H2,1-3H3
InChIKeyXQWQHPNSVWACIS-UHFFFAOYSA-N
XLogP2.32
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,7-Dimethyl-3-propan-2-yl-4,5-dihydrooxazepine
CID 91564422
3,4,6-trimethyl-4H-oxazine
CID 123445894
3,6-dimethyl-4H-oxazine
CID 142993482
6-methyl-3-(2-methylpropyl)-4H-oxazine
CID 143219950
3,6-dimethyl-4H-oxazine;ethane
CID 143399688
3-Tert-butyl-7-ethyl-4,5-dihydrooxazepine
CID 144399229
6-(2,3-dimethylbutyl)-3,4-dimethyl-4H-oxazine
CID 146581273
3,4-Dimethyl-7-propyl-4,5-dihydrooxazepine
CID 166706334
3,6-diethyl-4H-oxazine-4-carbonitrile
CID 12693703
(E)-1-cyclohex-3-en-1-yl-N-methoxyethanimine
CID 142535271
6-tert-butyl-3-methyl-4H-oxazine
CID 143053398
(E)-N-[(E)-hex-2-en-2-yl]oxy-3-methylbutan-2-imine
CID 178166520

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4,6-dimethyl-4H-oxazine?
The IUPAC name of 3-ethyl-4,6-dimethyl-4H-oxazine (CID 142167099) is 3-ethyl-4,6-dimethyl-4H-oxazine.
What is the SMILES notation for 3-ethyl-4,6-dimethyl-4H-oxazine?
The canonical SMILES for 3-ethyl-4,6-dimethyl-4H-oxazine is CCC1=NOC(C)=CC1C.
What is the InChIKey of 3-ethyl-4,6-dimethyl-4H-oxazine?
The InChIKey is XQWQHPNSVWACIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-4-8-6(2)5-7(3)10-9-8/h5-6H,4H2,1-3H3.
What are the key properties of 3-ethyl-4,6-dimethyl-4H-oxazine?
3-ethyl-4,6-dimethyl-4H-oxazine has a molecular weight of 139.20 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4,6-dimethyl-4H-oxazine is sourced from PubChem (CID 142167099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).