silyl pyrazine-2-carboxylate

C5H6N2O2Si — CID 137330489

IUPACsilyl pyrazine-2-carboxylate
SMILESO=C(O[SiH3])c1cnccn1
InChIInChI=1S/C5H6N2O2Si/c8-5(9-10)4-3-6-1-2-7-4/h1-3H,10H3
InChIKeyYPUOPJFNEPQRAZ-UHFFFAOYSA-N
MW154.20 g/mol
LogP-1.09
Rot. Bonds1

About silyl pyrazine-2-carboxylate

silyl pyrazine-2-carboxylate (PubChem CID 137330489) has the molecular formula C5H6N2O2Si and a molecular weight of 154.20 g/mol. Its IUPAC name is silyl pyrazine-2-carboxylate.

Molecular Properties

Compound Namesilyl pyrazine-2-carboxylate
PubChem CID137330489
Molecular FormulaC5H6N2O2Si
Molecular Weight154.20 g/mol
Exact Mass154.02
IUPAC Namesilyl pyrazine-2-carboxylate
SMILESO=C(O[SiH3])c1cnccn1
InChIInChI=1S/C5H6N2O2Si/c8-5(9-10)4-3-6-1-2-7-4/h1-3H,10H3
InChIKeyYPUOPJFNEPQRAZ-UHFFFAOYSA-N
XLogP-1.09
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.20
LogP ≤ 5-1.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

amino pyrazine-2-carboxylate
CID 67878279
trifluoromethyl pyrazine-2-carboxylate
CID 142296960
propan-2-yl pyrazine-2-carboxylate
CID 3022328
ethyl pyrazine-2-carboxylate;dihydrochloride
CID 141471889
platinum(2+);bis(pyrazine-2-carboxylic acid);dichloride
CID 54591628
tetrakis(pyrazine-2-carboxylic acid);zirconium
CID 172643699
pyrazine-2-carbothioic S-acid
CID 87249006
oxetan-3-yl pyrazine-2-carboxylate
CID 130693172
[tert-butyl(dimethyl)silyl] pyrazine-2-carboxylate
CID 91727571
[4-[4-(pyrazine-2-carbonyloxy)phenyl]sulfanylphenyl] pyrazine-2-carboxylate
CID 18077188
potassium;hydride;pyrazine-2-carboxylic acid
CID 174693780
pyrazine-2-carbonyl pyridazine-4-carboxylate
CID 175205992

Frequently Asked Questions

What is the IUPAC name of silyl pyrazine-2-carboxylate?
The IUPAC name of silyl pyrazine-2-carboxylate (CID 137330489) is silyl pyrazine-2-carboxylate.
What is the SMILES notation for silyl pyrazine-2-carboxylate?
The canonical SMILES for silyl pyrazine-2-carboxylate is O=C(O[SiH3])c1cnccn1.
What is the InChIKey of silyl pyrazine-2-carboxylate?
The InChIKey is YPUOPJFNEPQRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2Si/c8-5(9-10)4-3-6-1-2-7-4/h1-3H,10H3.
What are the key properties of silyl pyrazine-2-carboxylate?
silyl pyrazine-2-carboxylate has a molecular weight of 154.20 g/mol, XLogP of -1.09, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for silyl pyrazine-2-carboxylate is sourced from PubChem (CID 137330489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).