8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine

C12H9IN4O — CID 80875674

IUPAC8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(Oc2ccccc2I)n1
InChIInChI=1S/C12H9IN4O/c13-8-3-1-2-4-9(8)18-12-11-15-5-6-17(11)7-10(14)16-12/h1-7H,14H2
InChIKeyCYXKCXFALKVXQD-UHFFFAOYSA-N
MW352.14 g/mol
LogP2.71
Rot. Bonds2

About 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine

8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80875674) has the molecular formula C12H9IN4O and a molecular weight of 352.14 g/mol. Its IUPAC name is 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine
PubChem CID80875674
Molecular FormulaC12H9IN4O
Molecular Weight352.14 g/mol
Exact Mass351.98
IUPAC Name8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(Oc2ccccc2I)n1
InChIInChI=1S/C12H9IN4O/c13-8-3-1-2-4-9(8)18-12-11-15-5-6-17(11)7-10(14)16-12/h1-7H,14H2
InChIKeyCYXKCXFALKVXQD-UHFFFAOYSA-N
XLogP2.71
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.14
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

8-(5-fluoro-2-methylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 102989110
8-(2-methoxy-4-methylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80880981
8-(4-bromo-2-methylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80879807
8-(2-methyl-5-propan-2-ylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80875088
8-(5-bromo-2,3-difluorophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 107102607
8-(4-chloro-3,5-dimethylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80874590
8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80874626
8-(2-methyl-5-nitrophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80878888
[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
CID 80872480
8-[(2-fluorophenyl)methoxy]imidazo[1,2-a]pyrazin-6-amine
CID 80876110
8-N-(2-methoxyphenyl)-8-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80815985
8-heptoxyimidazo[1,2-a]pyrazin-6-amine
CID 80861684

Frequently Asked Questions

What is the IUPAC name of 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine (CID 80875674) is 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine is Nc1cn2ccnc2c(Oc2ccccc2I)n1.
What is the InChIKey of 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is CYXKCXFALKVXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9IN4O/c13-8-3-1-2-4-9(8)18-12-11-15-5-6-17(11)7-10(14)16-12/h1-7H,14H2.
What are the key properties of 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine?
8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 352.14 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-iodophenoxy)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80875674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).