6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one

C9H10N2O — CID 134292775

IUPAC6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one
SMILESC=Cc1[nH]c(=O)cnc1/C=C\C
InChIInChI=1S/C9H10N2O/c1-3-5-8-7(4-2)11-9(12)6-10-8/h3-6H,2H2,1H3,(H,11,12)/b5-3-
InChIKeyXAKNMCMIVMCFAR-HYXAFXHYSA-N
MW162.19 g/mol
LogP1.45
Rot. Bonds2

About 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one

6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one (PubChem CID 134292775) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one.

Molecular Properties

Compound Name6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one
PubChem CID134292775
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one
SMILESC=Cc1[nH]c(=O)cnc1/C=C\C
InChIInChI=1S/C9H10N2O/c1-3-5-8-7(4-2)11-9(12)6-10-8/h3-6H,2H2,1H3,(H,11,12)/b5-3-
InChIKeyXAKNMCMIVMCFAR-HYXAFXHYSA-N
XLogP1.45
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one?
The IUPAC name of 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one (CID 134292775) is 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one.
What is the SMILES notation for 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one?
The canonical SMILES for 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one is C=Cc1[nH]c(=O)cnc1/C=C\C.
What is the InChIKey of 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one?
The InChIKey is XAKNMCMIVMCFAR-HYXAFXHYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-3-5-8-7(4-2)11-9(12)6-10-8/h3-6H,2H2,1H3,(H,11,12)/b5-3-.
What are the key properties of 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one?
6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one has a molecular weight of 162.19 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrazin-2-one is sourced from PubChem (CID 134292775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).