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

C12H24N2O — CID 117226465

IUPAC5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane
SMILESCC1CNC(C2CCCN2C(C)C)OC1
InChIInChI=1S/C12H24N2O/c1-9(2)14-6-4-5-11(14)12-13-7-10(3)8-15-12/h9-13H,4-8H2,1-3H3
InChIKeyCNVXYGVEGCGRNY-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.44
Rot. Bonds2

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

5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane (PubChem CID 117226465) 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-2-yl)-1,3-oxazinane.

Molecular Properties

Compound Name5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane
PubChem CID117226465
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane
SMILESCC1CNC(C2CCCN2C(C)C)OC1
InChIInChI=1S/C12H24N2O/c1-9(2)14-6-4-5-11(14)12-13-7-10(3)8-15-12/h9-13H,4-8H2,1-3H3
InChIKeyCNVXYGVEGCGRNY-UHFFFAOYSA-N
XLogP1.44
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 ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazinane
CID 117226185
2-cyclohexyl-5-methyl-1,3-oxazinane;hydrochloride
CID 117227184
4,4-dimethyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazolidine;hydrochloride
CID 117227911
5-methyl-2-piperidin-3-yl-1,3-oxazinane
CID 117226391
4-(1-propan-2-ylpyrrolidin-2-yl)piperidine
CID 66273659
ethane;1-propan-2-yl-2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 158751144
[2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-dioxolan-4-yl]methanamine
CID 115094517
1-propan-2-yl-2-pyrrolidin-2-ylpiperidine
CID 63256346
2-propan-2-yl-7-sulfanyl-2,7-diazabicyclo[4.2.0]octane
CID 146439857
1-tert-butyl-5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1,5-naphthyridine
CID 164706311
(4aR,7aR)-4-propan-2-yl-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine
CID 170523770
2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1,3-oxazolidine;hydrochloride
CID 117225706

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane?
The IUPAC name of 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane (CID 117226465) is 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane.
What is the SMILES notation for 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane?
The canonical SMILES for 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane is CC1CNC(C2CCCN2C(C)C)OC1.
What is the InChIKey of 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane?
The InChIKey is CNVXYGVEGCGRNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)14-6-4-5-11(14)12-13-7-10(3)8-15-12/h9-13H,4-8H2,1-3H3.
What are the key properties of 5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane?
5-methyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazinane has a molecular weight of 212.34 g/mol, XLogP of 1.44, 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-2-yl)-1,3-oxazinane is sourced from PubChem (CID 117226465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).