4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one

C10H18FN3O2Si — CID 58166436

IUPAC4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one
SMILESC[Si](C)(C)CCOCn1cc(F)c(N)nc1=O
InChIInChI=1S/C10H18FN3O2Si/c1-17(2,3)5-4-16-7-14-6-8(11)9(12)13-10(14)15/h6H,4-5,7H2,1-3H3,(H2,12,13,15)
InChIKeyGZPCGFKVMWTHQH-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.28
Rot. Bonds5

About 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one

4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one (PubChem CID 58166436) has the molecular formula C10H18FN3O2Si and a molecular weight of 259.36 g/mol. Its IUPAC name is 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one.

Molecular Properties

Compound Name4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one
PubChem CID58166436
Molecular FormulaC10H18FN3O2Si
Molecular Weight259.36 g/mol
Exact Mass259.12
IUPAC Name4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one
SMILESC[Si](C)(C)CCOCn1cc(F)c(N)nc1=O
InChIInChI=1S/C10H18FN3O2Si/c1-17(2,3)5-4-16-7-14-6-8(11)9(12)13-10(14)15/h6H,4-5,7H2,1-3H3,(H2,12,13,15)
InChIKeyGZPCGFKVMWTHQH-UHFFFAOYSA-N
XLogP1.28
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-Amino-5-fluoro-1-(2-methoxyethoxymethyl)pyrimidin-2-one
CID 58166418
4-Amino-5-fluoro-1-(propoxymethyl)pyrimidin-2-one
CID 71215793
4-Amino-1-(ethoxymethyl)-5-fluoropyrimidin-2-one
CID 130330204
4-Amino-5-fluoro-1-(propan-2-yloxymethyl)pyrimidin-2-one
CID 130330273

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one?
The IUPAC name of 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one (CID 58166436) is 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one.
What is the SMILES notation for 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one?
The canonical SMILES for 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one is C[Si](C)(C)CCOCn1cc(F)c(N)nc1=O.
What is the InChIKey of 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one?
The InChIKey is GZPCGFKVMWTHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN3O2Si/c1-17(2,3)5-4-16-7-14-6-8(11)9(12)13-10(14)15/h6H,4-5,7H2,1-3H3,(H2,12,13,15).
What are the key properties of 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one?
4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one has a molecular weight of 259.36 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-fluoro-1-(2-trimethylsilylethoxymethyl)pyrimidin-2-one is sourced from PubChem (CID 58166436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).