lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate

C10H16LiNO5 — CID 134859282

IUPAClithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate
SMILESCC(C)(C)OC(=O)N1CCO[C@@H](C(=O)[O-])C1.[Li+]
InChIInChI=1S/C10H17NO5.Li/c1-10(2,3)16-9(14)11-4-5-15-7(6-11)8(12)13;/h7H,4-6H2,1-3H3,(H,12,13);/q;+1/p-1/t7-;/m1./s1
InChIKeyUSNLTWWHSGFIIE-OGFXRTJISA-M
MW237.18 g/mol
LogP-3.62
Rot. Bonds1

About lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate

lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate (PubChem CID 134859282) has the molecular formula C10H16LiNO5 and a molecular weight of 237.18 g/mol. Its IUPAC name is lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate.

Molecular Properties

Compound Namelithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate
PubChem CID134859282
Molecular FormulaC10H16LiNO5
Molecular Weight237.18 g/mol
Exact Mass237.12
IUPAC Namelithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate
SMILESCC(C)(C)OC(=O)N1CCO[C@@H](C(=O)[O-])C1.[Li+]
InChIInChI=1S/C10H17NO5.Li/c1-10(2,3)16-9(14)11-4-5-15-7(6-11)8(12)13;/h7H,4-6H2,1-3H3,(H,12,13);/q;+1/p-1/t7-;/m1./s1
InChIKeyUSNLTWWHSGFIIE-OGFXRTJISA-M
XLogP-3.62
TPSA78.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.18
LogP ≤ 5-3.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate
CID 35549476
tert-butyl 2-(cyclopropylcarbamoyl)morpholine-4-carboxylate
CID 59494690
tert-butyl 2-[1-[methyl(propan-2-yl)amino]ethenyl]morpholine-4-carboxylate
CID 123976217
tert-butyl 2-(2,2-dicyano-1-methoxyethenyl)morpholine-4-carboxylate
CID 178068955
tert-butyl 2-(5-methoxypentanoyl)morpholine-4-carboxylate
CID 57449676
tert-butyl 2-(2-ethoxyprop-2-enoyl)morpholine-4-carboxylate
CID 162741113
tert-butyl (2S)-2-(hydroxymethyl)morpholine-4-carboxylate;tert-butyl (2R)-2-(hydroxymethyl)morpholine-4-carboxylate
CID 86593644
tert-butyl 2-(aminomethyl)morpholine-4-carboxylate
CID 19081094
lithium 6-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]azocane-3-carboxylate
CID 171841250
tert-butyl 2-(3-fluorobenzoyl)morpholine-4-carboxylate
CID 68598494
tert-butyl (3R)-3-methylpyrrolidine-1-carboxylate
CID 59070240
tert-butyl (2S)-2-[(E)-3-methylsulfonyloxyprop-1-enyl]morpholine-4-carboxylate
CID 87947258

Frequently Asked Questions

What is the IUPAC name of lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate?
The IUPAC name of lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate (CID 134859282) is lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate.
What is the SMILES notation for lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate?
The canonical SMILES for lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate is CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)[O-])C1.[Li+].
What is the InChIKey of lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate?
The InChIKey is USNLTWWHSGFIIE-OGFXRTJISA-M. The full InChI is InChI=1S/C10H17NO5.Li/c1-10(2,3)16-9(14)11-4-5-15-7(6-11)8(12)13;/h7H,4-6H2,1-3H3,(H,12,13);/q;+1/p-1/t7-;/m1./s1.
What are the key properties of lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate?
lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate has a molecular weight of 237.18 g/mol, XLogP of -3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate is sourced from PubChem (CID 134859282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).