3-(2-iodophenoxy)pyrazin-2-amine

C10H8IN3O — CID 102988008

IUPAC3-(2-iodophenoxy)pyrazin-2-amine
SMILESNc1nccnc1Oc1ccccc1I
InChIInChI=1S/C10H8IN3O/c11-7-3-1-2-4-8(7)15-10-9(12)13-5-6-14-10/h1-6H,(H2,12,13)
InChIKeyAYGBOZLSACURDS-UHFFFAOYSA-N
MW313.10 g/mol
LogP2.46
Rot. Bonds2

About 3-(2-iodophenoxy)pyrazin-2-amine

3-(2-iodophenoxy)pyrazin-2-amine (PubChem CID 102988008) has the molecular formula C10H8IN3O and a molecular weight of 313.10 g/mol. Its IUPAC name is 3-(2-iodophenoxy)pyrazin-2-amine.

Molecular Properties

Compound Name3-(2-iodophenoxy)pyrazin-2-amine
PubChem CID102988008
Molecular FormulaC10H8IN3O
Molecular Weight313.10 g/mol
Exact Mass312.97
IUPAC Name3-(2-iodophenoxy)pyrazin-2-amine
SMILESNc1nccnc1Oc1ccccc1I
InChIInChI=1S/C10H8IN3O/c11-7-3-1-2-4-8(7)15-10-9(12)13-5-6-14-10/h1-6H,(H2,12,13)
InChIKeyAYGBOZLSACURDS-UHFFFAOYSA-N
XLogP2.46
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.10
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methylphenoxy)pyrazin-2-amine
CID 102987840
3-iodo-2-(2-iodophenoxy)pyridine
CID 11475735
3-(2-chlorophenoxy)pyrazin-2-amine
CID 102987821
[2-(3-aminopyrazin-2-yl)oxyphenyl]methanol
CID 102988200
3-bromo-2-(2-iodophenoxy)-4-methylpyridine
CID 106875361
6-(2-iodophenoxy)-5-propylpyrimidin-4-amine
CID 80875866
3-(2-iodophenoxy)-1-methylpyrazin-2-one
CID 62939733
1-(2-iodophenoxy)-5-methoxyisoquinoline
CID 106536969
3-(2,4-difluorophenoxy)pyrazin-2-amine
CID 102987748
2-(2-iodophenoxy)-1,3-thiazol-5-amine
CID 102769412
2-(2-iodophenoxy)pyrazine
CID 60965646
8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80875674

Frequently Asked Questions

What is the IUPAC name of 3-(2-iodophenoxy)pyrazin-2-amine?
The IUPAC name of 3-(2-iodophenoxy)pyrazin-2-amine (CID 102988008) is 3-(2-iodophenoxy)pyrazin-2-amine.
What is the SMILES notation for 3-(2-iodophenoxy)pyrazin-2-amine?
The canonical SMILES for 3-(2-iodophenoxy)pyrazin-2-amine is Nc1nccnc1Oc1ccccc1I.
What is the InChIKey of 3-(2-iodophenoxy)pyrazin-2-amine?
The InChIKey is AYGBOZLSACURDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8IN3O/c11-7-3-1-2-4-8(7)15-10-9(12)13-5-6-14-10/h1-6H,(H2,12,13).
What are the key properties of 3-(2-iodophenoxy)pyrazin-2-amine?
3-(2-iodophenoxy)pyrazin-2-amine has a molecular weight of 313.10 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-iodophenoxy)pyrazin-2-amine is sourced from PubChem (CID 102988008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).