strontium;(2R)-2-aminopentanedioate;hydrate

C5H9NO5Sr — CID 141288425

IUPACstrontium;(2R)-2-aminopentanedioate;hydrate
SMILESN[C@H](CCC(=O)[O-])C(=O)[O-].O.[Sr+2]
InChIInChI=1S/C5H9NO4.H2O.Sr/c6-3(5(9)10)1-2-4(7)8;;/h3H,1-2,6H2,(H,7,8)(H,9,10);1H2;/q;;+2/p-2/t3-;;/m1../s1
InChIKeyFNGRACUKFZAZSI-HWYNEVGZSA-L
MW250.75 g/mol
LogP-4.61
Rot. Bonds4

About strontium;(2R)-2-aminopentanedioate;hydrate

strontium;(2R)-2-aminopentanedioate;hydrate (PubChem CID 141288425) has the molecular formula C5H9NO5Sr and a molecular weight of 250.75 g/mol. Its IUPAC name is strontium;(2R)-2-aminopentanedioate;hydrate.

Molecular Properties

Compound Namestrontium;(2R)-2-aminopentanedioate;hydrate
PubChem CID141288425
Molecular FormulaC5H9NO5Sr
Molecular Weight250.75 g/mol
Exact Mass250.95
IUPAC Namestrontium;(2R)-2-aminopentanedioate;hydrate
SMILESN[C@H](CCC(=O)[O-])C(=O)[O-].O.[Sr+2]
InChIInChI=1S/C5H9NO4.H2O.Sr/c6-3(5(9)10)1-2-4(7)8;;/h3H,1-2,6H2,(H,7,8)(H,9,10);1H2;/q;;+2/p-2/t3-;;/m1../s1
InChIKeyFNGRACUKFZAZSI-HWYNEVGZSA-L
XLogP-4.61
TPSA137.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.75
LogP ≤ 5-4.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze strontium;(2R)-2-aminopentanedioate;hydrate with MolForge

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

Launch Full Analysis

Related Compounds

strontium;(2S)-2-aminopentanedioate;pentahydrate
CID 172813696
calcium;bis((2S)-2-aminopentanedioate);hydron;tetrahydrate
CID 91826886
(2S)-2-aminopentanedioate;cadmium(2+)
CID 159859619
diazanium;2-aminopentanedioate
CID 22497325
copper (2S)-2-aminopentanedioate
CID 87093217
(2S)-2-aminopentanedioate;nickel(2+)
CID 87532151
tris((2S)-2-aminopentanedioate);bis(cerium(3+))
CID 160944724
(2S)-2-aminopentanedioate;manganese(2+)
CID 10442757
calcium;bis((2S)-2-aminopentanedioate);hydride
CID 139033629
tetrasodium;2-aminopentanedioate;oxalate
CID 175012253
tetrasodium;2-aminopentanedioate;diacetate
CID 18668480
disodium;2-aminopentanedioate;ethane-1,2-diol
CID 174730127

Frequently Asked Questions

What is the IUPAC name of strontium;(2R)-2-aminopentanedioate;hydrate?
The IUPAC name of strontium;(2R)-2-aminopentanedioate;hydrate (CID 141288425) is strontium;(2R)-2-aminopentanedioate;hydrate.
What is the SMILES notation for strontium;(2R)-2-aminopentanedioate;hydrate?
The canonical SMILES for strontium;(2R)-2-aminopentanedioate;hydrate is N[C@H](CCC(=O)[O-])C(=O)[O-].O.[Sr+2].
What is the InChIKey of strontium;(2R)-2-aminopentanedioate;hydrate?
The InChIKey is FNGRACUKFZAZSI-HWYNEVGZSA-L. The full InChI is InChI=1S/C5H9NO4.H2O.Sr/c6-3(5(9)10)1-2-4(7)8;;/h3H,1-2,6H2,(H,7,8)(H,9,10);1H2;/q;;+2/p-2/t3-;;/m1../s1.
What are the key properties of strontium;(2R)-2-aminopentanedioate;hydrate?
strontium;(2R)-2-aminopentanedioate;hydrate has a molecular weight of 250.75 g/mol, XLogP of -4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for strontium;(2R)-2-aminopentanedioate;hydrate is sourced from PubChem (CID 141288425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).