5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane

C12H24N2O — CID 117226185

IUPAC5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane
SMILESCC1CNC(C2CCN(C(C)C)C2)OC1
InChIInChI=1S/C12H24N2O/c1-9(2)14-5-4-11(7-14)12-13-6-10(3)8-15-12/h9-13H,4-8H2,1-3H3
InChIKeyPZOSSXQJGCWEOR-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.30
Rot. Bonds2

About 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane

5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane (PubChem CID 117226185) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane.

Molecular Properties

Compound Name5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane
PubChem CID117226185
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane
SMILESCC1CNC(C2CCN(C(C)C)C2)OC1
InChIInChI=1S/C12H24N2O/c1-9(2)14-5-4-11(7-14)12-13-6-10(3)8-15-12/h9-13H,4-8H2,1-3H3
InChIKeyPZOSSXQJGCWEOR-UHFFFAOYSA-N
XLogP1.30
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazolidine;hydrochloride
CID 117227627
5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane
CID 117226465
2-cyclohexyl-5-methyl-1,3-oxazinane;hydrochloride
CID 117227184
4-methyl-2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazolidine;hydrochloride
CID 117227683
2,6-di(propan-2-yl)-1,3,4,4a,5,7,8,8a-octahydro-2,6-naphthyridine;2,7-di(propan-2-yl)-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine
CID 164996340
(6S)-3-propan-2-yl-3-azabicyclo[4.2.0]octane
CID 137467561
5-methyl-2-piperidin-3-yl-1,3-oxazinane
CID 117226391
(1R,6R)-3-propan-2-yl-3-azabicyclo[4.1.0]heptane
CID 176597082
ethane;3-methyl-1-propan-2-ylpyrrolidine
CID 156888189
(3aR)-6-propan-2-yl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine
CID 166764383
2-methyltellanyl-5-propan-2-yl-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridine
CID 171800016
1-propan-2-yl-4-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 59059970

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane?
The IUPAC name of 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane (CID 117226185) is 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane.
What is the SMILES notation for 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane?
The canonical SMILES for 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane is CC1CNC(C2CCN(C(C)C)C2)OC1.
What is the InChIKey of 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane?
The InChIKey is PZOSSXQJGCWEOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)14-5-4-11(7-14)12-13-6-10(3)8-15-12/h9-13H,4-8H2,1-3H3.
What are the key properties of 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane?
5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane has a molecular weight of 212.34 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane is sourced from PubChem (CID 117226185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).