4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one

C10H8Cl2N2O — CID 156762824

IUPAC4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one
SMILESO=C1CN(c2cccc(Cl)c2Cl)C=CN1
InChIInChI=1S/C10H8Cl2N2O/c11-7-2-1-3-8(10(7)12)14-5-4-13-9(15)6-14/h1-5H,6H2,(H,13,15)
InChIKeyQYNVZZQCXPULJP-UHFFFAOYSA-N
MW243.09 g/mol
LogP2.40
Rot. Bonds1

About 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one

4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one (PubChem CID 156762824) has the molecular formula C10H8Cl2N2O and a molecular weight of 243.09 g/mol. Its IUPAC name is 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one.

Molecular Properties

Compound Name4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one
PubChem CID156762824
Molecular FormulaC10H8Cl2N2O
Molecular Weight243.09 g/mol
Exact Mass242.00
IUPAC Name4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one
SMILESO=C1CN(c2cccc(Cl)c2Cl)C=CN1
InChIInChI=1S/C10H8Cl2N2O/c11-7-2-1-3-8(10(7)12)14-5-4-13-9(15)6-14/h1-5H,6H2,(H,13,15)
InChIKeyQYNVZZQCXPULJP-UHFFFAOYSA-N
XLogP2.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.09
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(2,3-dichlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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3-(2,3-dichlorophenyl)-2-oxo-1H-imidazole-4-carboxylic acid
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8-chloro-4-(4-chlorophenyl)-1,3-dihydroquinoxalin-2-one
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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one?
The IUPAC name of 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one (CID 156762824) is 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one.
What is the SMILES notation for 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one?
The canonical SMILES for 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one is O=C1CN(c2cccc(Cl)c2Cl)C=CN1.
What is the InChIKey of 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one?
The InChIKey is QYNVZZQCXPULJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2O/c11-7-2-1-3-8(10(7)12)14-5-4-13-9(15)6-14/h1-5H,6H2,(H,13,15).
What are the key properties of 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one?
4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one has a molecular weight of 243.09 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dichlorophenyl)-1,3-dihydropyrazin-2-one is sourced from PubChem (CID 156762824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).