(2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine

C10H21NO2 — CID 121401096

IUPAC(2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine
SMILESCOC[C@@H](C)CN1CCO[C@@H](C)C1
InChIInChI=1S/C10H21NO2/c1-9(8-12-3)6-11-4-5-13-10(2)7-11/h9-10H,4-8H2,1-3H3/t9-,10-/m0/s1
InChIKeySAFIEQQAQBMDIA-UWVGGRQHSA-N
MW187.28 g/mol
LogP0.99
Rot. Bonds4

About (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine

(2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine (PubChem CID 121401096) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine.

Molecular Properties

Compound Name(2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine
PubChem CID121401096
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name(2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine
SMILESCOC[C@@H](C)CN1CCO[C@@H](C)C1
InChIInChI=1S/C10H21NO2/c1-9(8-12-3)6-11-4-5-13-10(2)7-11/h9-10H,4-8H2,1-3H3/t9-,10-/m0/s1
InChIKeySAFIEQQAQBMDIA-UWVGGRQHSA-N
XLogP0.99
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-N-methyl-3-(2-methylmorpholin-4-yl)propan-2-amine
CID 107505257
2-methyl-3-(2-methylmorpholin-4-yl)propan-1-amine
CID 43174922
ethane;2-methyl-4-(2-methylpropyl)morpholine
CID 156652353
1-(2-methylmorpholin-4-yl)propan-2-ol
CID 60886312
(2S)-3-methyl-1-[(2S)-2-methylmorpholin-4-yl]butan-2-amine
CID 28597475
1-(2-methylmorpholin-4-yl)butan-2-ol
CID 60886313
ethane;ethene;(2S)-4-(3-methoxypropyl)-2-methylmorpholine
CID 154661350
(2R)-3,3-dimethyl-1-(2-methylmorpholin-4-yl)butan-2-amine
CID 130522025
(2S)-4-[3-(1-iodoethoxy)propyl]-2-methylmorpholine
CID 155023154
2-hydroxy-3-(2-methylmorpholin-4-yl)propanoic acid
CID 130593590
(2S)-4-[2-[(3R)-3-(methoxymethyl)azepan-1-yl]ethyl]-2-methylmorpholine
CID 124874777
1-cyclopentyl-N-methyl-2-(2-methylmorpholin-4-yl)ethanamine
CID 104744362

Frequently Asked Questions

What is the IUPAC name of (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine?
The IUPAC name of (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine (CID 121401096) is (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine.
What is the SMILES notation for (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine?
The canonical SMILES for (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine is COC[C@@H](C)CN1CCO[C@@H](C)C1.
What is the InChIKey of (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine?
The InChIKey is SAFIEQQAQBMDIA-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H21NO2/c1-9(8-12-3)6-11-4-5-13-10(2)7-11/h9-10H,4-8H2,1-3H3/t9-,10-/m0/s1.
What are the key properties of (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine?
(2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine has a molecular weight of 187.28 g/mol, XLogP of 0.99, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-[(2S)-3-methoxy-2-methylpropyl]-2-methylmorpholine is sourced from PubChem (CID 121401096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).