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

C10H20ClNO — CID 117227172

IUPAC2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
SMILESCC1(C)CNC(C2CCC2)OC1.Cl
InChIInChI=1S/C10H19NO.ClH/c1-10(2)6-11-9(12-7-10)8-4-3-5-8;/h8-9,11H,3-7H2,1-2H3;1H
InChIKeyMGJVRACVHAYZKF-UHFFFAOYSA-N
MW205.73 g/mol
LogP2.18
Rot. Bonds1

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

2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride (PubChem CID 117227172) has the molecular formula C10H20ClNO and a molecular weight of 205.73 g/mol. Its IUPAC name is 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride.

Molecular Properties

Compound Name2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
PubChem CID117227172
Molecular FormulaC10H20ClNO
Molecular Weight205.73 g/mol
Exact Mass205.12
IUPAC Name2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
SMILESCC1(C)CNC(C2CCC2)OC1.Cl
InChIInChI=1S/C10H19NO.ClH/c1-10(2)6-11-9(12-7-10)8-4-3-5-8;/h8-9,11H,3-7H2,1-2H3;1H
InChIKeyMGJVRACVHAYZKF-UHFFFAOYSA-N
XLogP2.18
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.73
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-5,5-dimethyl-1,3-oxazinane
CID 117227173
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
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-cyclobutyl-4,4-dimethyl-1,3-oxazolidine
CID 117228568
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
2-cyclohexyl-5-methyl-1,3-oxazinane;hydrochloride
CID 117227184

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride?
The IUPAC name of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride (CID 117227172) is 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride.
What is the SMILES notation for 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride?
The canonical SMILES for 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride is CC1(C)CNC(C2CCC2)OC1.Cl.
What is the InChIKey of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride?
The InChIKey is MGJVRACVHAYZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.ClH/c1-10(2)6-11-9(12-7-10)8-4-3-5-8;/h8-9,11H,3-7H2,1-2H3;1H.
What are the key properties of 2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride?
2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride has a molecular weight of 205.73 g/mol, XLogP of 2.18, 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;hydrochloride is sourced from PubChem (CID 117227172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).