8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine

C13H10ClFN4O — CID 116691368

IUPAC8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(Oc2cccc(Cl)c2F)n1
InChIInChI=1S/C13H10ClFN4O/c1-16-10-7-19-6-5-17-12(19)13(18-10)20-9-4-2-3-8(14)11(9)15/h2-7,16H,1H3
InChIKeyUXAQQPJTPFIAAY-UHFFFAOYSA-N
MW292.70 g/mol
LogP3.36
Rot. Bonds3

About 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine

8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 116691368) has the molecular formula C13H10ClFN4O and a molecular weight of 292.70 g/mol. Its IUPAC name is 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine
PubChem CID116691368
Molecular FormulaC13H10ClFN4O
Molecular Weight292.70 g/mol
Exact Mass292.05
IUPAC Name8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(Oc2cccc(Cl)c2F)n1
InChIInChI=1S/C13H10ClFN4O/c1-16-10-7-19-6-5-17-12(19)13(18-10)20-9-4-2-3-8(14)11(9)15/h2-7,16H,1H3
InChIKeyUXAQQPJTPFIAAY-UHFFFAOYSA-N
XLogP3.36
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.70
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine (CID 116691368) is 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine is CNc1cn2ccnc2c(Oc2cccc(Cl)c2F)n1.
What is the InChIKey of 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is UXAQQPJTPFIAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN4O/c1-16-10-7-19-6-5-17-12(19)13(18-10)20-9-4-2-3-8(14)11(9)15/h2-7,16H,1H3.
What are the key properties of 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine?
8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 292.70 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-chloro-2-fluorophenoxy)-N-methylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 116691368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).