2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane

C12H18N2O — CID 117226779

IUPAC2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane
SMILESCC1(C)CNC(C)(c2ccccn2)OC1
InChIInChI=1S/C12H18N2O/c1-11(2)8-14-12(3,15-9-11)10-6-4-5-7-13-10/h4-7,14H,8-9H2,1-3H3
InChIKeyGDNFNPADELIUMK-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.90
Rot. Bonds1

About 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane

2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane (PubChem CID 117226779) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane.

Molecular Properties

Compound Name2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane
PubChem CID117226779
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane
SMILESCC1(C)CNC(C)(c2ccccn2)OC1
InChIInChI=1S/C12H18N2O/c1-11(2)8-14-12(3,15-9-11)10-6-4-5-7-13-10/h4-7,14H,8-9H2,1-3H3
InChIKeyGDNFNPADELIUMK-UHFFFAOYSA-N
XLogP1.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethyl-2-pyridin-2-yl-1,3-oxazolidine
CID 117228214
5,5-dimethyl-2-pyridin-2-yl-1,3-oxazinane;hydrochloride
CID 117226776
4,4-dimethyl-3-oxido-2,2-dipyridin-2-yl-1,3-oxazolidine
CID 139049808
2-(5-bromofuran-2-yl)-2,5,5-trimethyl-1,3-oxazinane
CID 117226757
2-[(2,5,5-trimethyl-1,3-oxazinan-2-yl)methyl]phenol
CID 117226881
2-(2-methylpiperidin-2-yl)pyridine
CID 83529728
2-(3-methyl-1-bicyclo[1.1.1]pentanyl)pyridine
CID 163800991
2-[2,2-dimethyl-5-(4-methyl-1,3-dioxetan-2-yl)-1,3-dioxan-5-yl]pyridine
CID 71108844
2-(3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-6a-yl)pyridine
CID 54225097
2,5,5-trimethyl-2-[(2-methylphenyl)methyl]-1,3-oxazinane;hydrochloride
CID 117226848
2-(2,2-dimethylpiperidin-4-yl)pyridine
CID 117258212
2-[(2-methoxyphenyl)methyl]-2,5,5-trimethyl-1,3-oxazinane
CID 117226883

Frequently Asked Questions

What is the IUPAC name of 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane?
The IUPAC name of 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane (CID 117226779) is 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane.
What is the SMILES notation for 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane?
The canonical SMILES for 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane is CC1(C)CNC(C)(c2ccccn2)OC1.
What is the InChIKey of 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane?
The InChIKey is GDNFNPADELIUMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-11(2)8-14-12(3,15-9-11)10-6-4-5-7-13-10/h4-7,14H,8-9H2,1-3H3.
What are the key properties of 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane?
2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane has a molecular weight of 206.29 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,5-trimethyl-2-pyridin-2-yl-1,3-oxazinane is sourced from PubChem (CID 117226779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).