5-chloro-2-iodopyridin-3-amine

C5H4ClIN2 — CID 53485481

IUPAC5-chloro-2-iodopyridin-3-amine
SMILESNc1cc(Cl)cnc1I
InChIInChI=1S/C5H4ClIN2/c6-3-1-4(8)5(7)9-2-3/h1-2H,8H2
InChIKeyJYLCNFXOJAJGOM-UHFFFAOYSA-N
MW254.46 g/mol
LogP1.92
Rot. Bonds

About 5-chloro-2-iodopyridin-3-amine

5-chloro-2-iodopyridin-3-amine (PubChem CID 53485481) has the molecular formula C5H4ClIN2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 5-chloro-2-iodopyridin-3-amine.

Molecular Properties

Compound Name5-chloro-2-iodopyridin-3-amine
PubChem CID53485481
Molecular FormulaC5H4ClIN2
Molecular Weight254.46 g/mol
Exact Mass253.91
IUPAC Name5-chloro-2-iodopyridin-3-amine
SMILESNc1cc(Cl)cnc1I
InChIInChI=1S/C5H4ClIN2/c6-3-1-4(8)5(7)9-2-3/h1-2H,8H2
InChIKeyJYLCNFXOJAJGOM-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'}

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-iodopyridin-3-amine?
The IUPAC name of 5-chloro-2-iodopyridin-3-amine (CID 53485481) is 5-chloro-2-iodopyridin-3-amine.
What is the SMILES notation for 5-chloro-2-iodopyridin-3-amine?
The canonical SMILES for 5-chloro-2-iodopyridin-3-amine is Nc1cc(Cl)cnc1I.
What is the InChIKey of 5-chloro-2-iodopyridin-3-amine?
The InChIKey is JYLCNFXOJAJGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4ClIN2/c6-3-1-4(8)5(7)9-2-3/h1-2H,8H2.
What are the key properties of 5-chloro-2-iodopyridin-3-amine?
5-chloro-2-iodopyridin-3-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-2-iodopyridin-3-amine is sourced from PubChem (CID 53485481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).