N-ethyl-3-fluoro-4-iodopyridin-2-amine

C7H8FIN2 — CID 130456223

IUPACN-ethyl-3-fluoro-4-iodopyridin-2-amine
SMILESCCNc1nccc(I)c1F
InChIInChI=1S/C7H8FIN2/c1-2-10-7-6(8)5(9)3-4-11-7/h3-4H,2H2,1H3,(H,10,11)
InChIKeyAYQPDCAPKSJATB-UHFFFAOYSA-N
MW266.06 g/mol
LogP2.26
Rot. Bonds2

About N-ethyl-3-fluoro-4-iodopyridin-2-amine

N-ethyl-3-fluoro-4-iodopyridin-2-amine (PubChem CID 130456223) has the molecular formula C7H8FIN2 and a molecular weight of 266.06 g/mol. Its IUPAC name is N-ethyl-3-fluoro-4-iodopyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-fluoro-4-iodopyridin-2-amine
PubChem CID130456223
Molecular FormulaC7H8FIN2
Molecular Weight266.06 g/mol
Exact Mass265.97
IUPAC NameN-ethyl-3-fluoro-4-iodopyridin-2-amine
SMILESCCNc1nccc(I)c1F
InChIInChI=1S/C7H8FIN2/c1-2-10-7-6(8)5(9)3-4-11-7/h3-4H,2H2,1H3,(H,10,11)
InChIKeyAYQPDCAPKSJATB-UHFFFAOYSA-N
XLogP2.26
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.06
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-fluoro-4-iodopyridin-2-amine?
The IUPAC name of N-ethyl-3-fluoro-4-iodopyridin-2-amine (CID 130456223) is N-ethyl-3-fluoro-4-iodopyridin-2-amine.
What is the SMILES notation for N-ethyl-3-fluoro-4-iodopyridin-2-amine?
The canonical SMILES for N-ethyl-3-fluoro-4-iodopyridin-2-amine is CCNc1nccc(I)c1F.
What is the InChIKey of N-ethyl-3-fluoro-4-iodopyridin-2-amine?
The InChIKey is AYQPDCAPKSJATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FIN2/c1-2-10-7-6(8)5(9)3-4-11-7/h3-4H,2H2,1H3,(H,10,11).
What are the key properties of N-ethyl-3-fluoro-4-iodopyridin-2-amine?
N-ethyl-3-fluoro-4-iodopyridin-2-amine has a molecular weight of 266.06 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-fluoro-4-iodopyridin-2-amine is sourced from PubChem (CID 130456223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).