trimethylsilylmethyl (3R)-morpholine-3-carboxylate

C9H19NO3Si — CID 124636413

IUPACtrimethylsilylmethyl (3R)-morpholine-3-carboxylate
SMILESC[Si](C)(C)COC(=O)[C@H]1COCCN1
InChIInChI=1S/C9H19NO3Si/c1-14(2,3)7-13-9(11)8-6-12-5-4-10-8/h8,10H,4-7H2,1-3H3/t8-/m1/s1
InChIKeyFXUCINLGGJUUIB-MRVPVSSYSA-N
MW217.34 g/mol
LogP0.40
Rot. Bonds3

About trimethylsilylmethyl (3R)-morpholine-3-carboxylate

trimethylsilylmethyl (3R)-morpholine-3-carboxylate (PubChem CID 124636413) has the molecular formula C9H19NO3Si and a molecular weight of 217.34 g/mol. Its IUPAC name is trimethylsilylmethyl (3R)-morpholine-3-carboxylate.

Molecular Properties

Compound Nametrimethylsilylmethyl (3R)-morpholine-3-carboxylate
PubChem CID124636413
Molecular FormulaC9H19NO3Si
Molecular Weight217.34 g/mol
Exact Mass217.11
IUPAC Nametrimethylsilylmethyl (3R)-morpholine-3-carboxylate
SMILESC[Si](C)(C)COC(=O)[C@H]1COCCN1
InChIInChI=1S/C9H19NO3Si/c1-14(2,3)7-13-9(11)8-6-12-5-4-10-8/h8,10H,4-7H2,1-3H3/t8-/m1/s1
InChIKeyFXUCINLGGJUUIB-MRVPVSSYSA-N
XLogP0.40
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.34
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

ethyl (3R)-morpholine-3-carboxylate
CID 46839508
methyl (3S)-morpholine-3-carboxylate;hydrochloride
CID 42614245
benzyl (3S)-morpholine-3-carboxylate;hydrochloride
CID 46839500
benzyl (3R)-morpholine-3-carboxylate;hydrochloride
CID 46839509
1-morpholin-3-ylpropan-1-one
CID 54487560
ethane;morpholine-3-carboxylic acid
CID 144576497
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
(3S)-morpholine-3-carboxylic acid;hydrochloride
CID 42614332
2-[[(3S)-morpholine-3-carbonyl]amino]ethyl acetate
CID 118107617
1-morpholin-3-ylhex-4-yn-1-one
CID 116576446
methyl 2-(morpholine-3-carbonylamino)butanoate
CID 119709002
(3S)-N-(2-methoxyethyl)morpholine-3-carboxamide
CID 96998631

Frequently Asked Questions

What is the IUPAC name of trimethylsilylmethyl (3R)-morpholine-3-carboxylate?
The IUPAC name of trimethylsilylmethyl (3R)-morpholine-3-carboxylate (CID 124636413) is trimethylsilylmethyl (3R)-morpholine-3-carboxylate.
What is the SMILES notation for trimethylsilylmethyl (3R)-morpholine-3-carboxylate?
The canonical SMILES for trimethylsilylmethyl (3R)-morpholine-3-carboxylate is C[Si](C)(C)COC(=O)[C@H]1COCCN1.
What is the InChIKey of trimethylsilylmethyl (3R)-morpholine-3-carboxylate?
The InChIKey is FXUCINLGGJUUIB-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19NO3Si/c1-14(2,3)7-13-9(11)8-6-12-5-4-10-8/h8,10H,4-7H2,1-3H3/t8-/m1/s1.
What are the key properties of trimethylsilylmethyl (3R)-morpholine-3-carboxylate?
trimethylsilylmethyl (3R)-morpholine-3-carboxylate has a molecular weight of 217.34 g/mol, XLogP of 0.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilylmethyl (3R)-morpholine-3-carboxylate is sourced from PubChem (CID 124636413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).