(2-aminoethylamino) nitrate;palladium

C2H7N3O3Pd — CID 87666888

IUPAC(2-aminoethylamino) nitrate;palladium
SMILESNCCNO[N+](=O)[O-].[Pd]
InChIInChI=1S/C2H7N3O3.Pd/c3-1-2-4-8-5(6)7;/h4H,1-3H2;
InChIKeyKABCCDNSNBSYEQ-UHFFFAOYSA-N
MW227.52 g/mol
LogP-1.34
Rot. Bonds4

About (2-aminoethylamino) nitrate;palladium

(2-aminoethylamino) nitrate;palladium (PubChem CID 87666888) has the molecular formula C2H7N3O3Pd and a molecular weight of 227.52 g/mol. Its IUPAC name is (2-aminoethylamino) nitrate;palladium.

Molecular Properties

Compound Name(2-aminoethylamino) nitrate;palladium
PubChem CID87666888
Molecular FormulaC2H7N3O3Pd
Molecular Weight227.52 g/mol
Exact Mass226.95
IUPAC Name(2-aminoethylamino) nitrate;palladium
SMILESNCCNO[N+](=O)[O-].[Pd]
InChIInChI=1S/C2H7N3O3.Pd/c3-1-2-4-8-5(6)7;/h4H,1-3H2;
InChIKeyKABCCDNSNBSYEQ-UHFFFAOYSA-N
XLogP-1.34
TPSA90.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.52
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethane-1,2-diamine dinitrate
CID 3015097
(2-aminoethylamino) acetate;hydrochloride
CID 174583759
(2-aminoethylamino) acetate;chromium
CID 88783044
disodium;(2-aminoethylamino) acetate;hydride
CID 173366093
(2-aminoethylamino) N-aminocarbamate
CID 174871175
(2-aminoethylamino) acetate;cadmium;dihydrate
CID 174988758
(2-aminoethylamino) phosphate;manganese(2+)
CID 175393374
(2-aminoethylamino) dihydrogen phosphate;platinum
CID 175317533
amino nitrate;mercury
CID 174849220
amino nitrate;platinum
CID 174487148
silver;tris(ethane-1,2-diamine);nitrate
CID 173442409
ethane-1,2-diamine;platinum(2+);dinitrate
CID 11406311

Frequently Asked Questions

What is the IUPAC name of (2-aminoethylamino) nitrate;palladium?
The IUPAC name of (2-aminoethylamino) nitrate;palladium (CID 87666888) is (2-aminoethylamino) nitrate;palladium.
What is the SMILES notation for (2-aminoethylamino) nitrate;palladium?
The canonical SMILES for (2-aminoethylamino) nitrate;palladium is NCCNO[N+](=O)[O-].[Pd].
What is the InChIKey of (2-aminoethylamino) nitrate;palladium?
The InChIKey is KABCCDNSNBSYEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N3O3.Pd/c3-1-2-4-8-5(6)7;/h4H,1-3H2;.
What are the key properties of (2-aminoethylamino) nitrate;palladium?
(2-aminoethylamino) nitrate;palladium has a molecular weight of 227.52 g/mol, XLogP of -1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminoethylamino) nitrate;palladium is sourced from PubChem (CID 87666888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).