3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine

C6H3FIN3 — CID 155673162

IUPAC3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine
SMILESFc1cnc2c(I)c[nH]c2n1
InChIInChI=1S/C6H3FIN3/c7-4-2-9-5-3(8)1-10-6(5)11-4/h1-2H,(H,10,11)
InChIKeyVPWMQBDMVLHQRS-UHFFFAOYSA-N
MW263.01 g/mol
LogP1.70
Rot. Bonds

About 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine

3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 155673162) has the molecular formula C6H3FIN3 and a molecular weight of 263.01 g/mol. Its IUPAC name is 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine
PubChem CID155673162
Molecular FormulaC6H3FIN3
Molecular Weight263.01 g/mol
Exact Mass262.94
IUPAC Name3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine
SMILESFc1cnc2c(I)c[nH]c2n1
InChIInChI=1S/C6H3FIN3/c7-4-2-9-5-3(8)1-10-6(5)11-4/h1-2H,(H,10,11)
InChIKeyVPWMQBDMVLHQRS-UHFFFAOYSA-N
XLogP1.70
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.01
LogP ≤ 51.70
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 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (CID 155673162) is 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine is Fc1cnc2c(I)c[nH]c2n1.
What is the InChIKey of 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is VPWMQBDMVLHQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3FIN3/c7-4-2-9-5-3(8)1-10-6(5)11-4/h1-2H,(H,10,11).
What are the key properties of 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine?
3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 263.01 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-7-iodo-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 155673162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).