8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine

C15H15ClN4O — CID 80866350

IUPAC8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine
SMILESCCNc1cn2ccnc2c(Oc2ccc(Cl)c(C)c2)n1
InChIInChI=1S/C15H15ClN4O/c1-3-17-13-9-20-7-6-18-14(20)15(19-13)21-11-4-5-12(16)10(2)8-11/h4-9,17H,3H2,1-2H3
InChIKeyVNXXXNOGXISYQI-UHFFFAOYSA-N
MW302.77 g/mol
LogP3.92
Rot. Bonds4

About 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine

8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80866350) has the molecular formula C15H15ClN4O and a molecular weight of 302.77 g/mol. Its IUPAC name is 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80866350
Molecular FormulaC15H15ClN4O
Molecular Weight302.77 g/mol
Exact Mass302.09
IUPAC Name8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine
SMILESCCNc1cn2ccnc2c(Oc2ccc(Cl)c(C)c2)n1
InChIInChI=1S/C15H15ClN4O/c1-3-17-13-9-20-7-6-18-14(20)15(19-13)21-11-4-5-12(16)10(2)8-11/h4-9,17H,3H2,1-2H3
InChIKeyVNXXXNOGXISYQI-UHFFFAOYSA-N
XLogP3.92
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.77
LogP ≤ 53.92
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-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine (CID 80866350) is 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine is CCNc1cn2ccnc2c(Oc2ccc(Cl)c(C)c2)n1.
What is the InChIKey of 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is VNXXXNOGXISYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN4O/c1-3-17-13-9-20-7-6-18-14(20)15(19-13)21-11-4-5-12(16)10(2)8-11/h4-9,17H,3H2,1-2H3.
What are the key properties of 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine?
8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 302.77 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-chloro-3-methylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80866350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).