5-iodopyridin-2-amine

C10H10I2N4 — CID 157150642

IUPAC5-iodopyridin-2-amine
SMILESNc1ccc(I)cn1.Nc1ccc(I)cn1
InChIInChI=1S/2C5H5IN2/c2*6-4-1-2-5(7)8-3-4/h2*1-3H,(H2,7,8)
InChIKeyALFHAWDKAUCJLM-UHFFFAOYSA-N
MW440.03 g/mol
LogP2.54
Rot. Bonds

About 5-iodopyridin-2-amine

5-iodopyridin-2-amine (PubChem CID 157150642) has the molecular formula C10H10I2N4 and a molecular weight of 440.03 g/mol. Its IUPAC name is 5-iodopyridin-2-amine.

Molecular Properties

Compound Name5-iodopyridin-2-amine
PubChem CID157150642
Molecular FormulaC10H10I2N4
Molecular Weight440.03 g/mol
Exact Mass439.90
IUPAC Name5-iodopyridin-2-amine
SMILESNc1ccc(I)cn1.Nc1ccc(I)cn1
InChIInChI=1S/2C5H5IN2/c2*6-4-1-2-5(7)8-3-4/h2*1-3H,(H2,7,8)
InChIKeyALFHAWDKAUCJLM-UHFFFAOYSA-N
XLogP2.54
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.03
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-iodopyridin-2-amine?
The IUPAC name of 5-iodopyridin-2-amine (CID 157150642) is 5-iodopyridin-2-amine.
What is the SMILES notation for 5-iodopyridin-2-amine?
The canonical SMILES for 5-iodopyridin-2-amine is Nc1ccc(I)cn1.Nc1ccc(I)cn1.
What is the InChIKey of 5-iodopyridin-2-amine?
The InChIKey is ALFHAWDKAUCJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H5IN2/c2*6-4-1-2-5(7)8-3-4/h2*1-3H,(H2,7,8).
What are the key properties of 5-iodopyridin-2-amine?
5-iodopyridin-2-amine has a molecular weight of 440.03 g/mol, XLogP of 2.54, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodopyridin-2-amine is sourced from PubChem (CID 157150642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).