(2-aminoethylamino) nitrite;palladium

C2H7N3O2Pd — CID 87405376

IUPAC(2-aminoethylamino) nitrite;palladium
SMILESNCCNON=O.[Pd]
InChIInChI=1S/C2H7N3O2.Pd/c3-1-2-4-7-5-6;/h4H,1-3H2;
InChIKeyAUOJRTUOIPMFNN-UHFFFAOYSA-N
MW211.52 g/mol
LogP-0.85
Rot. Bonds4

About (2-aminoethylamino) nitrite;palladium

(2-aminoethylamino) nitrite;palladium (PubChem CID 87405376) has the molecular formula C2H7N3O2Pd and a molecular weight of 211.52 g/mol. Its IUPAC name is (2-aminoethylamino) nitrite;palladium.

Molecular Properties

Compound Name(2-aminoethylamino) nitrite;palladium
PubChem CID87405376
Molecular FormulaC2H7N3O2Pd
Molecular Weight211.52 g/mol
Exact Mass210.96
IUPAC Name(2-aminoethylamino) nitrite;palladium
SMILESNCCNON=O.[Pd]
InChIInChI=1S/C2H7N3O2.Pd/c3-1-2-4-7-5-6;/h4H,1-3H2;
InChIKeyAUOJRTUOIPMFNN-UHFFFAOYSA-N
XLogP-0.85
TPSA76.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.52
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-aminoethylamino) nitrite;palladium?
The IUPAC name of (2-aminoethylamino) nitrite;palladium (CID 87405376) is (2-aminoethylamino) nitrite;palladium.
What is the SMILES notation for (2-aminoethylamino) nitrite;palladium?
The canonical SMILES for (2-aminoethylamino) nitrite;palladium is NCCNON=O.[Pd].
What is the InChIKey of (2-aminoethylamino) nitrite;palladium?
The InChIKey is AUOJRTUOIPMFNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N3O2.Pd/c3-1-2-4-7-5-6;/h4H,1-3H2;.
What are the key properties of (2-aminoethylamino) nitrite;palladium?
(2-aminoethylamino) nitrite;palladium has a molecular weight of 211.52 g/mol, XLogP of -0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminoethylamino) nitrite;palladium is sourced from PubChem (CID 87405376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).