4-(6-methylpyrazin-2-yl)but-3-enamide

C9H11N3O — CID 170797338

IUPAC4-(6-methylpyrazin-2-yl)but-3-enamide
SMILESCc1cncc(C=CCC(N)=O)n1
InChIInChI=1S/C9H11N3O/c1-7-5-11-6-8(12-7)3-2-4-9(10)13/h2-3,5-6H,4H2,1H3,(H2,10,13)
InChIKeyDSSOPMSBFCTZMA-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.67
Rot. Bonds3

About 4-(6-methylpyrazin-2-yl)but-3-enamide

4-(6-methylpyrazin-2-yl)but-3-enamide (PubChem CID 170797338) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 4-(6-methylpyrazin-2-yl)but-3-enamide.

Molecular Properties

Compound Name4-(6-methylpyrazin-2-yl)but-3-enamide
PubChem CID170797338
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name4-(6-methylpyrazin-2-yl)but-3-enamide
SMILESCc1cncc(C=CCC(N)=O)n1
InChIInChI=1S/C9H11N3O/c1-7-5-11-6-8(12-7)3-2-4-9(10)13/h2-3,5-6H,4H2,1H3,(H2,10,13)
InChIKeyDSSOPMSBFCTZMA-UHFFFAOYSA-N
XLogP0.67
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(6-methylpyrazin-2-yl)but-3-enamide 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

3-(6-methylpyrazin-2-yl)prop-2-en-1-ol
CID 169452856
4-(6-methylpyrazin-2-yl)but-3-en-1-amine
CID 170486445
methyl 3-amino-6-(4-amino-4-oxobut-1-enyl)pyrazine-2-carboxylate
CID 170798601
4-(6-acetyl-2-pyridinyl)but-3-enamide
CID 170798002
4-(5-formyl-3-pyridinyl)but-3-enamide
CID 170797651
4-(5-bromopyrazin-2-yl)but-3-enamide
CID 170798931
ethyl (Z)-2-fluoro-3-(6-methylpyrazin-2-yl)prop-2-enoate
CID 170619052
4-(2-methyl-1H-imidazol-5-yl)but-3-enamide
CID 170797295
4-(3-methylimidazol-4-yl)but-3-enamide
CID 170797294
4-pyridin-2-ylbut-3-enamide
CID 170797301
4-(3,5-dimethylphenyl)but-3-enamide
CID 170797430
(E)-2-fluoro-3-(6-methylpyrazin-2-yl)prop-2-enoic acid
CID 170439155

Frequently Asked Questions

What is the IUPAC name of 4-(6-methylpyrazin-2-yl)but-3-enamide?
The IUPAC name of 4-(6-methylpyrazin-2-yl)but-3-enamide (CID 170797338) is 4-(6-methylpyrazin-2-yl)but-3-enamide.
What is the SMILES notation for 4-(6-methylpyrazin-2-yl)but-3-enamide?
The canonical SMILES for 4-(6-methylpyrazin-2-yl)but-3-enamide is Cc1cncc(C=CCC(N)=O)n1.
What is the InChIKey of 4-(6-methylpyrazin-2-yl)but-3-enamide?
The InChIKey is DSSOPMSBFCTZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-7-5-11-6-8(12-7)3-2-4-9(10)13/h2-3,5-6H,4H2,1H3,(H2,10,13).
What are the key properties of 4-(6-methylpyrazin-2-yl)but-3-enamide?
4-(6-methylpyrazin-2-yl)but-3-enamide has a molecular weight of 177.21 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methylpyrazin-2-yl)but-3-enamide is sourced from PubChem (CID 170797338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).