sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride

C2H8ClNNaO6P — CID 174054981

IUPACsodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride
SMILESCl.NCC(=O)O.O=P([O-])(O)O.[Na+]
InChIInChI=1S/C2H5NO2.ClH.Na.H3O4P/c3-1-2(4)5;;;1-5(2,3)4/h1,3H2,(H,4,5);1H;;(H3,1,2,3,4)/q;;+1;/p-1
InChIKeyFKYCAMFTCAKTTM-UHFFFAOYSA-M
MW231.50 g/mol
LogP-5.11
Rot. Bonds1

About sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride

sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride (PubChem CID 174054981) has the molecular formula C2H8ClNNaO6P and a molecular weight of 231.50 g/mol. Its IUPAC name is sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride.

Molecular Properties

Compound Namesodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride
PubChem CID174054981
Molecular FormulaC2H8ClNNaO6P
Molecular Weight231.50 g/mol
Exact Mass230.97
IUPAC Namesodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride
SMILESCl.NCC(=O)O.O=P([O-])(O)O.[Na+]
InChIInChI=1S/C2H5NO2.ClH.Na.H3O4P/c3-1-2(4)5;;;1-5(2,3)4/h1,3H2,(H,4,5);1H;;(H3,1,2,3,4)/q;;+1;/p-1
InChIKeyFKYCAMFTCAKTTM-UHFFFAOYSA-M
XLogP-5.11
TPSA143.91 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.50
LogP ≤ 5-5.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride 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

sodium;2-aminoacetic acid;bromide
CID 174820906
2-aminoacetic acid;methane;hydrochloride
CID 174614167
disodium;2-aminoacetic acid;hydrogen phosphate;2-hydroxypropane-1,2,3-tricarboxylic acid
CID 175196892
disodium;2-aminoacetic acid;hydrogen carbonate;hydroxide
CID 174055066
alumane;2-aminoacetic acid;zirconium;trihydrochloride
CID 173019361
bis(2-aminoacetic acid);copper
CID 50912486
2-aminoacetic acid;cadmium
CID 87269769
(2-aminoacetic acid);carbonic acid
CID 173312624
sodium dihydroxy(32P)phosphinate
CID 23694678
sodium;2-aminoacetic acid;methylsilanide
CID 174830355
tetrasodium;carbonic acid;dihydrogen phosphate;phosphate;dodecahydrate
CID 172838951
disodium;butanedioic acid;hydrogen phosphate;phosphoric acid
CID 160584781

Frequently Asked Questions

What is the IUPAC name of sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride?
The IUPAC name of sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride (CID 174054981) is sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride.
What is the SMILES notation for sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride?
The canonical SMILES for sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride is Cl.NCC(=O)O.O=P([O-])(O)O.[Na+].
What is the InChIKey of sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride?
The InChIKey is FKYCAMFTCAKTTM-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H5NO2.ClH.Na.H3O4P/c3-1-2(4)5;;;1-5(2,3)4/h1,3H2,(H,4,5);1H;;(H3,1,2,3,4)/q;;+1;/p-1.
What are the key properties of sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride?
sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride has a molecular weight of 231.50 g/mol, XLogP of -5.11, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;2-aminoacetic acid;dihydrogen phosphate;hydrochloride is sourced from PubChem (CID 174054981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).