2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one

C20H16ClN3O2 — CID 53118080

IUPAC2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one
SMILESCCOc1ccc(-n2ccn3cc(-c4cccc(Cl)c4)nc3c2=O)cc1
InChIInChI=1S/C20H16ClN3O2/c1-2-26-17-8-6-16(7-9-17)24-11-10-23-13-18(22-19(23)20(24)25)14-4-3-5-15(21)12-14/h3-13H,2H2,1H3
InChIKeyKRWQUKNCYMPEFQ-UHFFFAOYSA-N
MW365.82 g/mol
LogP4.20
Rot. Bonds4

About 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one

2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one (PubChem CID 53118080) has the molecular formula C20H16ClN3O2 and a molecular weight of 365.82 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one
PubChem CID53118080
Molecular FormulaC20H16ClN3O2
Molecular Weight365.82 g/mol
Exact Mass365.09
IUPAC Name2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one
SMILESCCOc1ccc(-n2ccn3cc(-c4cccc(Cl)c4)nc3c2=O)cc1
InChIInChI=1S/C20H16ClN3O2/c1-2-26-17-8-6-16(7-9-17)24-11-10-23-13-18(22-19(23)20(24)25)14-4-3-5-15(21)12-14/h3-13H,2H2,1H3
InChIKeyKRWQUKNCYMPEFQ-UHFFFAOYSA-N
XLogP4.20
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
The IUPAC name of 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one (CID 53118080) is 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one.
What is the SMILES notation for 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
The canonical SMILES for 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one is CCOc1ccc(-n2ccn3cc(-c4cccc(Cl)c4)nc3c2=O)cc1.
What is the InChIKey of 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
The InChIKey is KRWQUKNCYMPEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O2/c1-2-26-17-8-6-16(7-9-17)24-11-10-23-13-18(22-19(23)20(24)25)14-4-3-5-15(21)12-14/h3-13H,2H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one has a molecular weight of 365.82 g/mol, XLogP of 4.20, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-7-(4-ethoxyphenyl)imidazo[1,2-a]pyrazin-8-one is sourced from PubChem (CID 53118080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).