3,5-dichloro-1-phenylpyrazin-2-one

C10H6Cl2N2O — CID 11299460

IUPAC3,5-dichloro-1-phenylpyrazin-2-one
SMILESO=c1c(Cl)nc(Cl)cn1-c1ccccc1
InChIInChI=1S/C10H6Cl2N2O/c11-8-6-14(10(15)9(12)13-8)7-4-2-1-3-5-7/h1-6H
InChIKeyLJWHJYYNMORUIH-UHFFFAOYSA-N
MW241.08 g/mol
LogP2.54
Rot. Bonds1

About 3,5-dichloro-1-phenylpyrazin-2-one

3,5-dichloro-1-phenylpyrazin-2-one (PubChem CID 11299460) has the molecular formula C10H6Cl2N2O and a molecular weight of 241.08 g/mol. Its IUPAC name is 3,5-dichloro-1-phenylpyrazin-2-one.

Molecular Properties

Compound Name3,5-dichloro-1-phenylpyrazin-2-one
PubChem CID11299460
Molecular FormulaC10H6Cl2N2O
Molecular Weight241.08 g/mol
Exact Mass239.99
IUPAC Name3,5-dichloro-1-phenylpyrazin-2-one
SMILESO=c1c(Cl)nc(Cl)cn1-c1ccccc1
InChIInChI=1S/C10H6Cl2N2O/c11-8-6-14(10(15)9(12)13-8)7-4-2-1-3-5-7/h1-6H
InChIKeyLJWHJYYNMORUIH-UHFFFAOYSA-N
XLogP2.54
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.08
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-1-phenylpyrazin-2-one?
The IUPAC name of 3,5-dichloro-1-phenylpyrazin-2-one (CID 11299460) is 3,5-dichloro-1-phenylpyrazin-2-one.
What is the SMILES notation for 3,5-dichloro-1-phenylpyrazin-2-one?
The canonical SMILES for 3,5-dichloro-1-phenylpyrazin-2-one is O=c1c(Cl)nc(Cl)cn1-c1ccccc1.
What is the InChIKey of 3,5-dichloro-1-phenylpyrazin-2-one?
The InChIKey is LJWHJYYNMORUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2O/c11-8-6-14(10(15)9(12)13-8)7-4-2-1-3-5-7/h1-6H.
What are the key properties of 3,5-dichloro-1-phenylpyrazin-2-one?
3,5-dichloro-1-phenylpyrazin-2-one has a molecular weight of 241.08 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-1-phenylpyrazin-2-one is sourced from PubChem (CID 11299460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).