Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate

C10H16LiNO5 — CID 134859282

IUPAClithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate
SMILES[Li+].CC(C)(C)OC(=O)N1CCO[C@H](C1)C(=O)[O-]
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
MW237.20 g/mol
LogP—
Rot. Bonds3

About Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate

Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate (PubChem CID 134859282) has the molecular formula C10H16LiNO5 and a molecular weight of 237.20 g/mol. Its IUPAC name is lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate.

Molecular Properties

Compound NameLithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate
PubChem CID134859282
Molecular FormulaC10H16LiNO5
Molecular Weight237.20 g/mol
Exact Mass237.12
IUPAC Namelithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate
SMILES[Li+].CC(C)(C)OC(=O)N1CCO[C@H](C1)C(=O)[O-]
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—
TPSA78.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity289

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate?
The IUPAC name of Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate (CID 134859282) is lithium (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate.
What is the SMILES notation for Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate?
The canonical SMILES for Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate is [Li+].CC(C)(C)OC(=O)N1CCO[C@H](C1)C(=O)[O-].
What is the InChIKey of Lithium (R)-4-(tert-butoxycarbonyl)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 (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate?
Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate has a molecular weight of 237.20 g/mol, XLogP of not available, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for Lithium (R)-4-(tert-butoxycarbonyl)morpholine-2-carboxylate is sourced from PubChem (CID 134859282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).