(6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine

C13H27NO2 — CID 95236081

IUPAC(6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
SMILESC[C@H]1CN(CCOC(C)(C)C)CC(C)(C)O1
InChIInChI=1S/C13H27NO2/c1-11-9-14(10-13(5,6)16-11)7-8-15-12(2,3)4/h11H,7-10H2,1-6H3/t11-/m0/s1
InChIKeyVBVQZNZPMSHXTG-NSHDSACASA-N
MW229.36 g/mol
LogP2.30
Rot. Bonds3

About (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine

(6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine (PubChem CID 95236081) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine.

Molecular Properties

Compound Name(6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
PubChem CID95236081
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name(6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
SMILESC[C@H]1CN(CCOC(C)(C)C)CC(C)(C)O1
InChIInChI=1S/C13H27NO2/c1-11-9-14(10-13(5,6)16-11)7-8-15-12(2,3)4/h11H,7-10H2,1-6H3/t11-/m0/s1
InChIKeyVBVQZNZPMSHXTG-NSHDSACASA-N
XLogP2.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine with MolForge

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Related Compounds

6-(chloromethyl)-2,2-dimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
CID 114780607
2,6-dimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine
CID 47811029
2,2,6-trimethyl-4-[2-(3-methylazetidin-3-yl)oxyethyl]morpholine
CID 102656869
2,2-dimethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-amine
CID 65254263
2,2,2-trifluoro-N-[2-(2,2,6-trimethylmorpholin-4-yl)ethyl]ethanamine
CID 62555443
6-(2,2,6-trimethylmorpholin-4-yl)hexan-3-ol
CID 106802367
2-methyl-N-[[1-[(2,2,6-trimethylmorpholin-4-yl)methyl]cyclopentyl]methyl]propan-2-amine
CID 62260292
N-(dicyclopropylmethyl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanamine
CID 62555292
4-(2,2-diethoxyethyl)-2,2,6-trimethylmorpholine
CID 63618876
2-(cyclopropylamino)-2-methyl-6-(2,2,6-trimethylmorpholin-4-yl)hexan-1-ol
CID 64790148
4-methyl-N-[2-(2,2,6-trimethylmorpholin-4-yl)ethyl]pentan-1-amine
CID 62555294
1-cyclopentyl-2-(2,2,6-trimethylmorpholin-4-yl)ethanol
CID 104752739

Frequently Asked Questions

What is the IUPAC name of (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
The IUPAC name of (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine (CID 95236081) is (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine.
What is the SMILES notation for (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
The canonical SMILES for (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine is C[C@H]1CN(CCOC(C)(C)C)CC(C)(C)O1.
What is the InChIKey of (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
The InChIKey is VBVQZNZPMSHXTG-NSHDSACASA-N. The full InChI is InChI=1S/C13H27NO2/c1-11-9-14(10-13(5,6)16-11)7-8-15-12(2,3)4/h11H,7-10H2,1-6H3/t11-/m0/s1.
What are the key properties of (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine?
(6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine has a molecular weight of 229.36 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2,2,6-trimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine is sourced from PubChem (CID 95236081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).