2-cyclobutyl-5,5-dimethyl-1,3-oxazinane

C10H19NO — CID 117227173

IUPAC2-cyclobutyl-5,5-dimethyl-1,3-oxazinane
SMILESCC1(C)CNC(C2CCC2)OC1
InChIInChI=1S/C10H19NO/c1-10(2)6-11-9(12-7-10)8-4-3-5-8/h8-9,11H,3-7H2,1-2H3
InChIKeyZSNFTHSDXJBDOP-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.76
Rot. Bonds1

About 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane

2-cyclobutyl-5,5-dimethyl-1,3-oxazinane (PubChem CID 117227173) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane.

Molecular Properties

Compound Name2-cyclobutyl-5,5-dimethyl-1,3-oxazinane
PubChem CID117227173
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-cyclobutyl-5,5-dimethyl-1,3-oxazinane
SMILESCC1(C)CNC(C2CCC2)OC1
InChIInChI=1S/C10H19NO/c1-10(2)6-11-9(12-7-10)8-4-3-5-8/h8-9,11H,3-7H2,1-2H3
InChIKeyZSNFTHSDXJBDOP-UHFFFAOYSA-N
XLogP1.76
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117227172
2-cyclohexyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117227188
4-(5,5-dimethyl-1,3-oxazinan-2-yl)thiane 1,1-dioxide
CID 117226211
2-(1-ethylpiperidin-4-yl)-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117226246
2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine
CID 117228568
5,5-dimethyl-2-(oxolan-2-yl)-1,3-oxazinane;hydrochloride
CID 117226426
5,5-dimethyl-2-(thiolan-2-yl)-1,3-oxazinane;hydrochloride
CID 117226442
2-(1-ethylpyrrolidin-2-yl)-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117226470
2-cyclopentyl-5,5-dimethyl-1,3-oxazolidine
CID 117229147
(4aR,7aS)-3,3-dimethyl-1,2,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine
CID 160776877
2-cyclopentyl-4,4-dimethylpyrrolidine
CID 138485504
5,5-dimethyl-2-(thian-2-ylmethyl)-1,3-oxazinane
CID 117226611

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane?
The IUPAC name of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane (CID 117227173) is 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane.
What is the SMILES notation for 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane?
The canonical SMILES for 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane is CC1(C)CNC(C2CCC2)OC1.
What is the InChIKey of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane?
The InChIKey is ZSNFTHSDXJBDOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10(2)6-11-9(12-7-10)8-4-3-5-8/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane?
2-cyclobutyl-5,5-dimethyl-1,3-oxazinane has a molecular weight of 169.27 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane is sourced from PubChem (CID 117227173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).