2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride

C12H25ClN2O — CID 117226234

IUPAC2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride
SMILESCC1(C)CNC(C)(C2CCNCC2)OC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-11(2)8-14-12(3,15-9-11)10-4-6-13-7-5-10;/h10,13-14H,4-9H2,1-3H3;1H
InChIKeySUIDPBUMIDTIFI-UHFFFAOYSA-N
MW248.80 g/mol
LogP1.77
Rot. Bonds1

About 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride

2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride (PubChem CID 117226234) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride.

Molecular Properties

Compound Name2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride
PubChem CID117226234
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC Name2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride
SMILESCC1(C)CNC(C)(C2CCNCC2)OC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-11(2)8-14-12(3,15-9-11)10-4-6-13-7-5-10;/h10,13-14H,4-9H2,1-3H3;1H
InChIKeySUIDPBUMIDTIFI-UHFFFAOYSA-N
XLogP1.77
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5,5-trimethyl-2-(thian-4-yl)-1,3-oxazinane;hydrochloride
CID 117226220
2,5,5-trimethyl-2-(1-methylpyrrolidin-3-yl)-1,3-oxazinane;hydrochloride
CID 117226180
3-(2,5,5-trimethyl-1,3-oxazinan-2-yl)thiane 1,1-dioxide;hydrochloride
CID 117226380
2,5,5-trimethyl-2-(1-methylpyrrolidin-2-yl)-1,3-oxazinane
CID 117226461
2-cyclopropyl-2-methyl-1,3-oxazolidine;hydrochloride
CID 117227541
2-piperidin-4-yl-1,3-oxazolidin-2-ol;hydrochloride
CID 174907794
2-[(1-ethylpyrrolidin-2-yl)methyl]-2,5,5-trimethyl-1,3-oxazinane;hydrochloride
CID 117226586
4-(4-methyloxan-4-yl)piperidine
CID 83906763
2,5,5-trimethyl-2-(oxan-3-ylmethyl)-1,3-oxazinane
CID 117226653
3-(4-methyl-2,6,7-trioxabicyclo[2.2.1]heptan-1-yl)pyrrolidine
CID 115010708
2,4,4-trimethyl-2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazolidine;hydrochloride
CID 117227695
2,4,4-trimethyl-2-(oxolan-3-yl)-1,3-oxazolidine;hydrochloride
CID 117227591

Frequently Asked Questions

What is the IUPAC name of 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride?
The IUPAC name of 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride (CID 117226234) is 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride.
What is the SMILES notation for 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride?
The canonical SMILES for 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride is CC1(C)CNC(C)(C2CCNCC2)OC1.Cl.
What is the InChIKey of 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride?
The InChIKey is SUIDPBUMIDTIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-11(2)8-14-12(3,15-9-11)10-4-6-13-7-5-10;/h10,13-14H,4-9H2,1-3H3;1H.
What are the key properties of 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride?
2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 1.77, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,5-trimethyl-2-piperidin-4-yl-1,3-oxazinane;hydrochloride is sourced from PubChem (CID 117226234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).