5-chloropent-1-ene;copper(1+)

C5H8ClCu — CID 15646345

IUPAC5-chloropent-1-ene;copper(1+)
SMILES[Cu+].[H]/[C-]=C\CCCCl
InChIInChI=1S/C5H8Cl.Cu/c1-2-3-4-5-6;/h1-2H,3-5H2;/q-1;+1
InChIKeyLSAAAFNTCLUTTF-UHFFFAOYSA-N
MW167.12 g/mol
LogP1.99
Rot. Bonds3

About 5-chloropent-1-ene;copper(1+)

5-chloropent-1-ene;copper(1+) (PubChem CID 15646345) has the molecular formula C5H8ClCu and a molecular weight of 167.12 g/mol. Its IUPAC name is 5-chloropent-1-ene;copper(1+).

Molecular Properties

Compound Name5-chloropent-1-ene;copper(1+)
PubChem CID15646345
Molecular FormulaC5H8ClCu
Molecular Weight167.12 g/mol
Exact Mass165.96
IUPAC Name5-chloropent-1-ene;copper(1+)
SMILES[Cu+].[H]/[C-]=C\CCCCl
InChIInChI=1S/C5H8Cl.Cu/c1-2-3-4-5-6;/h1-2H,3-5H2;/q-1;+1
InChIKeyLSAAAFNTCLUTTF-UHFFFAOYSA-N
XLogP1.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.12
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 5-chloropent-1-ene;copper(1+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloropent-1-ene;copper(1+)?
The IUPAC name of 5-chloropent-1-ene;copper(1+) (CID 15646345) is 5-chloropent-1-ene;copper(1+).
What is the SMILES notation for 5-chloropent-1-ene;copper(1+)?
The canonical SMILES for 5-chloropent-1-ene;copper(1+) is [Cu+].[H]/[C-]=C\CCCCl.
What is the InChIKey of 5-chloropent-1-ene;copper(1+)?
The InChIKey is LSAAAFNTCLUTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8Cl.Cu/c1-2-3-4-5-6;/h1-2H,3-5H2;/q-1;+1.
What are the key properties of 5-chloropent-1-ene;copper(1+)?
5-chloropent-1-ene;copper(1+) has a molecular weight of 167.12 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloropent-1-ene;copper(1+) is sourced from PubChem (CID 15646345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).