2-chloropyridine;iodomethane

C6H7ClIN — CID 15747513

IUPAC2-chloropyridine;iodomethane
SMILESCI.Clc1ccccn1
InChIInChI=1S/C5H4ClN.CH3I/c6-5-3-1-2-4-7-5;1-2/h1-4H;1H3
InChIKeyZKUIZEYJZXEIJW-UHFFFAOYSA-N
MW255.49 g/mol
LogP2.79
Rot. Bonds

About 2-chloropyridine;iodomethane

2-chloropyridine;iodomethane (PubChem CID 15747513) has the molecular formula C6H7ClIN and a molecular weight of 255.49 g/mol. Its IUPAC name is 2-chloropyridine;iodomethane.

Molecular Properties

Compound Name2-chloropyridine;iodomethane
PubChem CID15747513
Molecular FormulaC6H7ClIN
Molecular Weight255.49 g/mol
Exact Mass254.93
IUPAC Name2-chloropyridine;iodomethane
SMILESCI.Clc1ccccn1
InChIInChI=1S/C5H4ClN.CH3I/c6-5-3-1-2-4-7-5;1-2/h1-4H;1H3
InChIKeyZKUIZEYJZXEIJW-UHFFFAOYSA-N
XLogP2.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.49
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloropyridine;iodomethane?
The IUPAC name of 2-chloropyridine;iodomethane (CID 15747513) is 2-chloropyridine;iodomethane.
What is the SMILES notation for 2-chloropyridine;iodomethane?
The canonical SMILES for 2-chloropyridine;iodomethane is CI.Clc1ccccn1.
What is the InChIKey of 2-chloropyridine;iodomethane?
The InChIKey is ZKUIZEYJZXEIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4ClN.CH3I/c6-5-3-1-2-4-7-5;1-2/h1-4H;1H3.
What are the key properties of 2-chloropyridine;iodomethane?
2-chloropyridine;iodomethane has a molecular weight of 255.49 g/mol, XLogP of 2.79, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloropyridine;iodomethane is sourced from PubChem (CID 15747513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).