8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine

C12H8ClFN4O — CID 82719370

IUPAC8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(Oc2ccc(Cl)c(F)c2)n1
InChIInChI=1S/C12H8ClFN4O/c13-8-2-1-7(5-9(8)14)19-12-11-16-3-4-18(11)6-10(15)17-12/h1-6H,15H2
InChIKeyQTJOWYBYEYILMN-UHFFFAOYSA-N
MW278.67 g/mol
LogP2.90
Rot. Bonds2

About 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine

8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 82719370) has the molecular formula C12H8ClFN4O and a molecular weight of 278.67 g/mol. Its IUPAC name is 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine
PubChem CID82719370
Molecular FormulaC12H8ClFN4O
Molecular Weight278.67 g/mol
Exact Mass278.04
IUPAC Name8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(Oc2ccc(Cl)c(F)c2)n1
InChIInChI=1S/C12H8ClFN4O/c13-8-2-1-7(5-9(8)14)19-12-11-16-3-4-18(11)6-10(15)17-12/h1-6H,15H2
InChIKeyQTJOWYBYEYILMN-UHFFFAOYSA-N
XLogP2.90
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.67
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine (CID 82719370) is 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine is Nc1cn2ccnc2c(Oc2ccc(Cl)c(F)c2)n1.
What is the InChIKey of 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is QTJOWYBYEYILMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFN4O/c13-8-2-1-7(5-9(8)14)19-12-11-16-3-4-18(11)6-10(15)17-12/h1-6H,15H2.
What are the key properties of 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine?
8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 278.67 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-chloro-3-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 82719370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).