5-chloro-6-iodopyridin-2-amine

C5H4ClIN2 — CID 130701003

IUPAC5-chloro-6-iodopyridin-2-amine
SMILESNc1ccc(Cl)c(I)n1
InChIInChI=1S/C5H4ClIN2/c6-3-1-2-4(8)9-5(3)7/h1-2H,(H2,8,9)
InChIKeyNOUSHVLZVWQJME-UHFFFAOYSA-N
MW254.46 g/mol
LogP1.92
Rot. Bonds

About 5-chloro-6-iodopyridin-2-amine

5-chloro-6-iodopyridin-2-amine (PubChem CID 130701003) has the molecular formula C5H4ClIN2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 5-chloro-6-iodopyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-iodopyridin-2-amine
PubChem CID130701003
Molecular FormulaC5H4ClIN2
Molecular Weight254.46 g/mol
Exact Mass253.91
IUPAC Name5-chloro-6-iodopyridin-2-amine
SMILESNc1ccc(Cl)c(I)n1
InChIInChI=1S/C5H4ClIN2/c6-3-1-2-4(8)9-5(3)7/h1-2H,(H2,8,9)
InChIKeyNOUSHVLZVWQJME-UHFFFAOYSA-N
XLogP1.92
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-chloro-6-iodopyridin-2-amine 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-chloro-6-iodopyridin-2-amine?
The IUPAC name of 5-chloro-6-iodopyridin-2-amine (CID 130701003) is 5-chloro-6-iodopyridin-2-amine.
What is the SMILES notation for 5-chloro-6-iodopyridin-2-amine?
The canonical SMILES for 5-chloro-6-iodopyridin-2-amine is Nc1ccc(Cl)c(I)n1.
What is the InChIKey of 5-chloro-6-iodopyridin-2-amine?
The InChIKey is NOUSHVLZVWQJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4ClIN2/c6-3-1-2-4(8)9-5(3)7/h1-2H,(H2,8,9).
What are the key properties of 5-chloro-6-iodopyridin-2-amine?
5-chloro-6-iodopyridin-2-amine has a molecular weight of 254.46 g/mol, XLogP of 1.92, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-iodopyridin-2-amine is sourced from PubChem (CID 130701003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).