copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)

C10H16CuN2O6 — CID 25216296

IUPACcopper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)
SMILESO=C([O-])[C@@H]1C[C@@H](O)CN1.O=C([O-])[C@@H]1C[C@@H](O)CN1.[Cu+2]
InChIInChI=1S/2C5H9NO3.Cu/c2*7-3-1-4(5(8)9)6-2-3;/h2*3-4,6-7H,1-2H2,(H,8,9);/q;;+2/p-2/t2*3-,4+;/m11./s1
InChIKeyNNAIRDOXDASAIH-OGXRZFKVSA-L
MW323.79 g/mol
LogP-5.08
Rot. Bonds2

About copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)

copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate) (PubChem CID 25216296) has the molecular formula C10H16CuN2O6 and a molecular weight of 323.79 g/mol. Its IUPAC name is copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate).

Molecular Properties

Compound Namecopper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)
PubChem CID25216296
Molecular FormulaC10H16CuN2O6
Molecular Weight323.79 g/mol
Exact Mass323.03
IUPAC Namecopper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)
SMILESO=C([O-])[C@@H]1C[C@@H](O)CN1.O=C([O-])[C@@H]1C[C@@H](O)CN1.[Cu+2]
InChIInChI=1S/2C5H9NO3.Cu/c2*7-3-1-4(5(8)9)6-2-3;/h2*3-4,6-7H,1-2H2,(H,8,9);/q;;+2/p-2/t2*3-,4+;/m11./s1
InChIKeyNNAIRDOXDASAIH-OGXRZFKVSA-L
XLogP-5.08
TPSA144.78 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.79
LogP ≤ 5-5.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Related Compounds

sodium (2S)-4-hydroxypyrrolidine-2-carboxylate
CID 141122108
potassium aziridine-2-carboxylate
CID 23673795
1-[(2S)-4-hydroxypyrrolidin-2-yl]ethanone
CID 154429079
(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydrochloride
CID 11205991
(2S)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 68860939
(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane
CID 131716757
amino (2S,4R)-4-hydroxypyrrolidine-2-carboxylate
CID 159655489
methyl (2S,4S)-4-hydroxypyrrolidine-2-carboxylate
CID 7021050
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
CID 19907192
(2S,4R)-4-hydroxypyrrolidine-2-carbohydrazide
CID 45084250
methyl (2R,4R)-4-hydroxypyrrolidine-2-carboxylate;hydrochloride
CID 12764090
4-hydroxypyrrolidine-2-carboxylic acid;2-(trimethylazaniumyl)acetate
CID 19098789

Frequently Asked Questions

What is the IUPAC name of copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)?
The IUPAC name of copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate) (CID 25216296) is copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate).
What is the SMILES notation for copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)?
The canonical SMILES for copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate) is O=C([O-])[C@@H]1C[C@@H](O)CN1.O=C([O-])[C@@H]1C[C@@H](O)CN1.[Cu+2].
What is the InChIKey of copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)?
The InChIKey is NNAIRDOXDASAIH-OGXRZFKVSA-L. The full InChI is InChI=1S/2C5H9NO3.Cu/c2*7-3-1-4(5(8)9)6-2-3;/h2*3-4,6-7H,1-2H2,(H,8,9);/q;;+2/p-2/t2*3-,4+;/m11./s1.
What are the key properties of copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)?
copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate) has a molecular weight of 323.79 g/mol, XLogP of -5.08, 2 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate) is sourced from PubChem (CID 25216296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).