5-iodo-4-methoxypyridin-2-amine

C6H7IN2O — CID 58053751

IUPAC5-iodo-4-methoxypyridin-2-amine
SMILESCOc1cc(N)ncc1I
InChIInChI=1S/C6H7IN2O/c1-10-5-2-6(8)9-3-4(5)7/h2-3H,1H3,(H2,8,9)
InChIKeyQWGWTCVCNBZBHK-UHFFFAOYSA-N
MW250.04 g/mol
LogP1.28
Rot. Bonds1

About 5-iodo-4-methoxypyridin-2-amine

5-iodo-4-methoxypyridin-2-amine (PubChem CID 58053751) has the molecular formula C6H7IN2O and a molecular weight of 250.04 g/mol. Its IUPAC name is 5-iodo-4-methoxypyridin-2-amine.

Molecular Properties

Compound Name5-iodo-4-methoxypyridin-2-amine
PubChem CID58053751
Molecular FormulaC6H7IN2O
Molecular Weight250.04 g/mol
Exact Mass249.96
IUPAC Name5-iodo-4-methoxypyridin-2-amine
SMILESCOc1cc(N)ncc1I
InChIInChI=1S/C6H7IN2O/c1-10-5-2-6(8)9-3-4(5)7/h2-3H,1H3,(H2,8,9)
InChIKeyQWGWTCVCNBZBHK-UHFFFAOYSA-N
XLogP1.28
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.04
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-iodo-4-methoxypyridin-2-amine?
The IUPAC name of 5-iodo-4-methoxypyridin-2-amine (CID 58053751) is 5-iodo-4-methoxypyridin-2-amine.
What is the SMILES notation for 5-iodo-4-methoxypyridin-2-amine?
The canonical SMILES for 5-iodo-4-methoxypyridin-2-amine is COc1cc(N)ncc1I.
What is the InChIKey of 5-iodo-4-methoxypyridin-2-amine?
The InChIKey is QWGWTCVCNBZBHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7IN2O/c1-10-5-2-6(8)9-3-4(5)7/h2-3H,1H3,(H2,8,9).
What are the key properties of 5-iodo-4-methoxypyridin-2-amine?
5-iodo-4-methoxypyridin-2-amine has a molecular weight of 250.04 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-4-methoxypyridin-2-amine is sourced from PubChem (CID 58053751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).