bis(3-aminopropanoic acid);platinum

C6H14N2O4Pt — CID 88672305

IUPACbis(3-aminopropanoic acid);platinum
SMILESNCCC(=O)O.NCCC(=O)O.[Pt]
InChIInChI=1S/2C3H7NO2.Pt/c2*4-2-1-3(5)6;/h2*1-2,4H2,(H,5,6);
InChIKeyBSMWRAOUNIYQKB-UHFFFAOYSA-N
MW373.27 g/mol
LogP-1.16
Rot. Bonds4

About bis(3-aminopropanoic acid);platinum

bis(3-aminopropanoic acid);platinum (PubChem CID 88672305) has the molecular formula C6H14N2O4Pt and a molecular weight of 373.27 g/mol. Its IUPAC name is bis(3-aminopropanoic acid);platinum.

Molecular Properties

Compound Namebis(3-aminopropanoic acid);platinum
PubChem CID88672305
Molecular FormulaC6H14N2O4Pt
Molecular Weight373.27 g/mol
Exact Mass373.06
IUPAC Namebis(3-aminopropanoic acid);platinum
SMILESNCCC(=O)O.NCCC(=O)O.[Pt]
InChIInChI=1S/2C3H7NO2.Pt/c2*4-2-1-3(5)6;/h2*1-2,4H2,(H,5,6);
InChIKeyBSMWRAOUNIYQKB-UHFFFAOYSA-N
XLogP-1.16
TPSA126.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.27
LogP ≤ 5-1.16
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of bis(3-aminopropanoic acid);platinum?
The IUPAC name of bis(3-aminopropanoic acid);platinum (CID 88672305) is bis(3-aminopropanoic acid);platinum.
What is the SMILES notation for bis(3-aminopropanoic acid);platinum?
The canonical SMILES for bis(3-aminopropanoic acid);platinum is NCCC(=O)O.NCCC(=O)O.[Pt].
What is the InChIKey of bis(3-aminopropanoic acid);platinum?
The InChIKey is BSMWRAOUNIYQKB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7NO2.Pt/c2*4-2-1-3(5)6;/h2*1-2,4H2,(H,5,6);.
What are the key properties of bis(3-aminopropanoic acid);platinum?
bis(3-aminopropanoic acid);platinum has a molecular weight of 373.27 g/mol, XLogP of -1.16, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-aminopropanoic acid);platinum is sourced from PubChem (CID 88672305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).