ethane;4-methyl-1,2-dihydropyrazin-3-one

C7H14N2O — CID 142943855

IUPACethane;4-methyl-1,2-dihydropyrazin-3-one
SMILESCC.CN1C=CNCC1=O
InChIInChI=1S/C5H8N2O.C2H6/c1-7-3-2-6-4-5(7)8;1-2/h2-3,6H,4H2,1H3;1-2H3
InChIKeyBJEUTDCRABVVQT-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.55
Rot. Bonds

About ethane;4-methyl-1,2-dihydropyrazin-3-one

ethane;4-methyl-1,2-dihydropyrazin-3-one (PubChem CID 142943855) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is ethane;4-methyl-1,2-dihydropyrazin-3-one.

Molecular Properties

Compound Nameethane;4-methyl-1,2-dihydropyrazin-3-one
PubChem CID142943855
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Nameethane;4-methyl-1,2-dihydropyrazin-3-one
SMILESCC.CN1C=CNCC1=O
InChIInChI=1S/C5H8N2O.C2H6/c1-7-3-2-6-4-5(7)8;1-2/h2-3,6H,4H2,1H3;1-2H3
InChIKeyBJEUTDCRABVVQT-UHFFFAOYSA-N
XLogP0.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;4-methyl-1,2-dihydropyrazin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Pyrazine-2,3-diol
CID 2774693
1-Methyl-1,2,3,4-tetrahydropyrazine-2,3-dione
CID 13366344
3,4-dihydro-1H-pyrazin-2-one
CID 19739714
1-(2,3-dihydro-1H-pyrazin-4-yl)ethanone
CID 168451761
1-Ethyl-1,4-dihydropyrazine-2,3-dione
CID 13366245
Vinylglycine ketimine
CID 18794948
4-Fluoro-1,3-dihydropyrazin-2-one
CID 169792298
4-(Trifluoromethyl)-1,2-dihydropyrazin-3-one
CID 175961772
1-Isopropyl-1,4-dihydropyrazine-2,3-dione
CID 13366346
2-(1H-pyrazin-4-yl)acetamide
CID 18366663
4-(2-oxopropyl)-1H-pyrazine-2,3-dione
CID 18741245
4-ethyl-1-methyl-2H-pyrazin-3-one
CID 20660447

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-1,2-dihydropyrazin-3-one?
The IUPAC name of ethane;4-methyl-1,2-dihydropyrazin-3-one (CID 142943855) is ethane;4-methyl-1,2-dihydropyrazin-3-one.
What is the SMILES notation for ethane;4-methyl-1,2-dihydropyrazin-3-one?
The canonical SMILES for ethane;4-methyl-1,2-dihydropyrazin-3-one is CC.CN1C=CNCC1=O.
What is the InChIKey of ethane;4-methyl-1,2-dihydropyrazin-3-one?
The InChIKey is BJEUTDCRABVVQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O.C2H6/c1-7-3-2-6-4-5(7)8;1-2/h2-3,6H,4H2,1H3;1-2H3.
What are the key properties of ethane;4-methyl-1,2-dihydropyrazin-3-one?
ethane;4-methyl-1,2-dihydropyrazin-3-one has a molecular weight of 142.20 g/mol, XLogP of 0.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-1,2-dihydropyrazin-3-one is sourced from PubChem (CID 142943855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).