1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one

C16H24N4O2Si — CID 154785538

IUPAC1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one
SMILESCC(C)(C)[Si](C)(C)OCCn1ccc(-c2cnccn2)nc1=O
InChIInChI=1S/C16H24N4O2Si/c1-16(2,3)23(4,5)22-11-10-20-9-6-13(19-15(20)21)14-12-17-7-8-18-14/h6-9,12H,10-11H2,1-5H3
InChIKeyZUKZUXAUESCCKV-UHFFFAOYSA-N
MW332.48 g/mol
LogP2.72
Rot. Bonds5

About 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one

1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one (PubChem CID 154785538) has the molecular formula C16H24N4O2Si and a molecular weight of 332.48 g/mol. Its IUPAC name is 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one.

Molecular Properties

Compound Name1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one
PubChem CID154785538
Molecular FormulaC16H24N4O2Si
Molecular Weight332.48 g/mol
Exact Mass332.17
IUPAC Name1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one
SMILESCC(C)(C)[Si](C)(C)OCCn1ccc(-c2cnccn2)nc1=O
InChIInChI=1S/C16H24N4O2Si/c1-16(2,3)23(4,5)22-11-10-20-9-6-13(19-15(20)21)14-12-17-7-8-18-14/h6-9,12H,10-11H2,1-5H3
InChIKeyZUKZUXAUESCCKV-UHFFFAOYSA-N
XLogP2.72
TPSA69.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.48
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one?
The IUPAC name of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one (CID 154785538) is 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one.
What is the SMILES notation for 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one?
The canonical SMILES for 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one is CC(C)(C)[Si](C)(C)OCCn1ccc(-c2cnccn2)nc1=O.
What is the InChIKey of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one?
The InChIKey is ZUKZUXAUESCCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2Si/c1-16(2,3)23(4,5)22-11-10-20-9-6-13(19-15(20)21)14-12-17-7-8-18-14/h6-9,12H,10-11H2,1-5H3.
What are the key properties of 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one?
1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one has a molecular weight of 332.48 g/mol, XLogP of 2.72, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-pyrazin-2-ylpyrimidin-2-one is sourced from PubChem (CID 154785538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).