2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane

C8H17NO — CID 91500061

IUPAC2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane
SMILESCC.CC1=NCCC(C)O1
InChIInChI=1S/C6H11NO.C2H6/c1-5-3-4-7-6(2)8-5;1-2/h5H,3-4H2,1-2H3;1-2H3
InChIKeyUSDWQHVERQFHAN-UHFFFAOYSA-N
MW143.23 g/mol
LogP2.24
Rot. Bonds

About 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane

2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane (PubChem CID 91500061) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane.

Molecular Properties

Compound Name2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane
PubChem CID91500061
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane
SMILESCC.CC1=NCCC(C)O1
InChIInChI=1S/C6H11NO.C2H6/c1-5-3-4-7-6(2)8-5;1-2/h5H,3-4H2,1-2H3;1-2H3
InChIKeyUSDWQHVERQFHAN-UHFFFAOYSA-N
XLogP2.24
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-5,6-dihydro-4H-1,3-oxazin-2-amine
CID 89188885
(6R)-2,4,4,6-tetramethyl-5,6-dihydro-1,3-oxazine
CID 7004113
ethane;2-methyl-5,6-dihydro-4H-1,3-oxazine
CID 91154236
6-methyloxan-2-one
CID 160564586
2,5,7-trimethyl-3,4-dihydro-2H-thieno[3,4-b]pyran
CID 155032390
2,6-dimethyl-4-propan-2-yl-5,6-dihydro-1,3,4-oxadiazine
CID 23272780
5-methyloxolan-2-one
CID 69397003
6-methyloxan-2-one;5-methyloxolan-2-one
CID 142135496
(15S)-15-methyl-oxacyclopentadecan-2-one
CID 86278289
(2-methyl-4,5-dihydro-1,3-oxazol-5-yl)methanamine
CID 115060788
(16R)-16-methyl-oxacyclohexadecan-2-one
CID 10978020
(14R)-14-methyl-oxacyclotetradecan-2-one
CID 11009676

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane?
The IUPAC name of 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane (CID 91500061) is 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane.
What is the SMILES notation for 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane?
The canonical SMILES for 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane is CC.CC1=NCCC(C)O1.
What is the InChIKey of 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane?
The InChIKey is USDWQHVERQFHAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.C2H6/c1-5-3-4-7-6(2)8-5;1-2/h5H,3-4H2,1-2H3;1-2H3.
What are the key properties of 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane?
2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane has a molecular weight of 143.23 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-5,6-dihydro-4H-1,3-oxazine;ethane is sourced from PubChem (CID 91500061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).