2-methanidylprop-1-ene;palladium

C4H7Pd- — CID 5028243

IUPAC2-methanidylprop-1-ene;palladium
SMILESC=C([CH2-])C.[Pd]
InChIInChI=1S/C4H7.Pd/c1-4(2)3;/h1-2H2,3H3;/q-1;
InChIKeyNWAKLMYKMCIOPU-UHFFFAOYSA-N
MW161.52 g/mol
LogP1.39
Rot. Bonds

About 2-methanidylprop-1-ene;palladium

2-methanidylprop-1-ene;palladium (PubChem CID 5028243) has the molecular formula C4H7Pd- and a molecular weight of 161.52 g/mol. Its IUPAC name is 2-methanidylprop-1-ene;palladium.

Molecular Properties

Compound Name2-methanidylprop-1-ene;palladium
PubChem CID5028243
Molecular FormulaC4H7Pd-
Molecular Weight161.52 g/mol
Exact Mass160.96
IUPAC Name2-methanidylprop-1-ene;palladium
SMILESC=C([CH2-])C.[Pd]
InChIInChI=1S/C4H7.Pd/c1-4(2)3;/h1-2H2,3H3;/q-1;
InChIKeyNWAKLMYKMCIOPU-UHFFFAOYSA-N
XLogP1.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.52
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methanidylprop-1-ene;palladium?
The IUPAC name of 2-methanidylprop-1-ene;palladium (CID 5028243) is 2-methanidylprop-1-ene;palladium.
What is the SMILES notation for 2-methanidylprop-1-ene;palladium?
The canonical SMILES for 2-methanidylprop-1-ene;palladium is C=C([CH2-])C.[Pd].
What is the InChIKey of 2-methanidylprop-1-ene;palladium?
The InChIKey is NWAKLMYKMCIOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7.Pd/c1-4(2)3;/h1-2H2,3H3;/q-1;.
What are the key properties of 2-methanidylprop-1-ene;palladium?
2-methanidylprop-1-ene;palladium has a molecular weight of 161.52 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methanidylprop-1-ene;palladium is sourced from PubChem (CID 5028243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).