2-(3-iodophenoxy)pyrazine

C10H7IN2O — CID 60644113

IUPAC2-(3-iodophenoxy)pyrazine
SMILESIc1cccc(Oc2cnccn2)c1
InChIInChI=1S/C10H7IN2O/c11-8-2-1-3-9(6-8)14-10-7-12-4-5-13-10/h1-7H
InChIKeyVCOPPZNHPAMQBC-UHFFFAOYSA-N
MW298.08 g/mol
LogP2.87
Rot. Bonds2

About 2-(3-iodophenoxy)pyrazine

2-(3-iodophenoxy)pyrazine (PubChem CID 60644113) has the molecular formula C10H7IN2O and a molecular weight of 298.08 g/mol. Its IUPAC name is 2-(3-iodophenoxy)pyrazine.

Molecular Properties

Compound Name2-(3-iodophenoxy)pyrazine
PubChem CID60644113
Molecular FormulaC10H7IN2O
Molecular Weight298.08 g/mol
Exact Mass297.96
IUPAC Name2-(3-iodophenoxy)pyrazine
SMILESIc1cccc(Oc2cnccn2)c1
InChIInChI=1S/C10H7IN2O/c11-8-2-1-3-9(6-8)14-10-7-12-4-5-13-10/h1-7H
InChIKeyVCOPPZNHPAMQBC-UHFFFAOYSA-N
XLogP2.87
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.08
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-pyrazin-2-yloxyphenoxy)pyrazine
CID 101444877
2-(chloromethyl)-6-(3-iodophenoxy)pyrazine
CID 66467349
6-(3-iodophenoxy)-N-methylpyrazin-2-amine
CID 80881366
5-tert-butyl-2-(3-iodophenoxy)pyridine
CID 107874372
2-(4-phenylphenoxy)pyrazine
CID 518373
2-(2-iodophenoxy)pyrazine
CID 60965646
2-(3-iodophenoxy)-6-methylpyridine
CID 61400141
1-iodo-3-[3-[4-(3-iodophenoxy)phenoxy]phenoxy]benzene
CID 22494556
5-chloro-4-(chloromethyl)-2-(3-iodophenoxy)pyridine
CID 114921271
2-[6-(3-iodophenoxy)-3-pyridinyl]ethanamine
CID 80639888
2-[(3-pyrazin-2-yloxyphenyl)methylideneamino]guanidine
CID 168591514
2-methyl-2-[methyl-(3-pyrazin-2-yloxybenzoyl)amino]propanoic acid
CID 120518751

Frequently Asked Questions

What is the IUPAC name of 2-(3-iodophenoxy)pyrazine?
The IUPAC name of 2-(3-iodophenoxy)pyrazine (CID 60644113) is 2-(3-iodophenoxy)pyrazine.
What is the SMILES notation for 2-(3-iodophenoxy)pyrazine?
The canonical SMILES for 2-(3-iodophenoxy)pyrazine is Ic1cccc(Oc2cnccn2)c1.
What is the InChIKey of 2-(3-iodophenoxy)pyrazine?
The InChIKey is VCOPPZNHPAMQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7IN2O/c11-8-2-1-3-9(6-8)14-10-7-12-4-5-13-10/h1-7H.
What are the key properties of 2-(3-iodophenoxy)pyrazine?
2-(3-iodophenoxy)pyrazine has a molecular weight of 298.08 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-iodophenoxy)pyrazine is sourced from PubChem (CID 60644113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).