2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid

C10H12N4O4 — CID 14101217

IUPAC2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid
SMILESCC(NC(=O)CNC(=O)c1cnccn1)C(=O)O
InChIInChI=1S/C10H12N4O4/c1-6(10(17)18)14-8(15)5-13-9(16)7-4-11-2-3-12-7/h2-4,6H,5H2,1H3,(H,13,16)(H,14,15)(H,17,18)
InChIKeyTVXSVHWGYWHBOI-UHFFFAOYSA-N
MW252.23 g/mol
LogP-1.20
Rot. Bonds5

About 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid

2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid (PubChem CID 14101217) has the molecular formula C10H12N4O4 and a molecular weight of 252.23 g/mol. Its IUPAC name is 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid.

Molecular Properties

Compound Name2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid
PubChem CID14101217
Molecular FormulaC10H12N4O4
Molecular Weight252.23 g/mol
Exact Mass252.09
IUPAC Name2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid
SMILESCC(NC(=O)CNC(=O)c1cnccn1)C(=O)O
InChIInChI=1S/C10H12N4O4/c1-6(10(17)18)14-8(15)5-13-9(16)7-4-11-2-3-12-7/h2-4,6H,5H2,1H3,(H,13,16)(H,14,15)(H,17,18)
InChIKeyTVXSVHWGYWHBOI-UHFFFAOYSA-N
XLogP-1.20
TPSA121.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.23
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid 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

N-[2-[[(1R)-1-hydroxy-3-methylbutyl]amino]-2-oxoethyl]pyrazine-2-carboxamide
CID 144733404
N-(3-methyl-2-oxobutyl)pyrazine-2-carboxamide
CID 103874912
N-[2-[[(2S)-1-amino-1-oxobutan-2-yl]amino]-2-oxoethyl]pyrazine-2-carboxamide
CID 70297294
N-[2-[(3,3-dimethyl-1-oxobutan-2-yl)amino]-2-oxoethyl]pyrazine-2-carboxamide
CID 142990533
N-(2-methylprop-2-enyl)pyrazine-2-carboxamide
CID 114618266
[2-phenyl-1-[[2-(pyrazine-2-carbonylamino)acetyl]amino]ethyl]boronic acid
CID 142596570
N-(4-hydroxy-2-methylbutyl)pyrazine-2-carboxamide
CID 66106195
(2S)-4-hydroxy-2-(pyrazine-2-carbonylamino)butanoic acid
CID 107822419
N-(2-amino-2-oxoethyl)pyrazine-2-carboxamide
CID 14101204
N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
N-[(2S)-1-amino-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 130166243

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid?
The IUPAC name of 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid (CID 14101217) is 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid.
What is the SMILES notation for 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid?
The canonical SMILES for 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid is CC(NC(=O)CNC(=O)c1cnccn1)C(=O)O.
What is the InChIKey of 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid?
The InChIKey is TVXSVHWGYWHBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O4/c1-6(10(17)18)14-8(15)5-13-9(16)7-4-11-2-3-12-7/h2-4,6H,5H2,1H3,(H,13,16)(H,14,15)(H,17,18).
What are the key properties of 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid?
2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid has a molecular weight of 252.23 g/mol, XLogP of -1.20, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(pyrazine-2-carbonylamino)acetyl]amino]propanoic acid is sourced from PubChem (CID 14101217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).