3-trimethylsilylpyridine-4-carboxylic acid

C9H13NO2Si — CID 14673408

IUPAC3-trimethylsilylpyridine-4-carboxylic acid
SMILESC[Si](C)(C)c1cnccc1C(=O)O
InChIInChI=1S/C9H13NO2Si/c1-13(2,3)8-6-10-5-4-7(8)9(11)12/h4-6H,1-3H3,(H,11,12)
InChIKeyYMEDAHXDSBATCN-UHFFFAOYSA-N
MW195.29 g/mol
LogP1.33
Rot. Bonds2

About 3-trimethylsilylpyridine-4-carboxylic acid

3-trimethylsilylpyridine-4-carboxylic acid (PubChem CID 14673408) has the molecular formula C9H13NO2Si and a molecular weight of 195.29 g/mol. Its IUPAC name is 3-trimethylsilylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-trimethylsilylpyridine-4-carboxylic acid
PubChem CID14673408
Molecular FormulaC9H13NO2Si
Molecular Weight195.29 g/mol
Exact Mass195.07
IUPAC Name3-trimethylsilylpyridine-4-carboxylic acid
SMILESC[Si](C)(C)c1cnccc1C(=O)O
InChIInChI=1S/C9H13NO2Si/c1-13(2,3)8-6-10-5-4-7(8)9(11)12/h4-6H,1-3H3,(H,11,12)
InChIKeyYMEDAHXDSBATCN-UHFFFAOYSA-N
XLogP1.33
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methyliodanuidylpyridine-4-carboxylic acid
CID 148860741
3-(4-carboxy-3-pyridinyl)pyridine-4-carboxylic acid
CID 91435588
pyridine-3,4-dicarboxylic acid;dihydrochloride
CID 70421739
3-acetylpyridine-4-carboxylic acid
CID 19902844
4-(methylcarbamoyl)pyridine-3-carboxylic acid
CID 130493888
3-(2-hydroxypropan-2-yl)pyridine-4-carboxylic acid
CID 175712799
3-(4-methylphenyl)pyridine-4-carboxylic acid
CID 19865918
3-(hydroxymethyl)pyridine-4-carboxylic acid
CID 12758257
5-(4-methyl-3-pyridinyl)-1,2-oxazole-4-carboxylic acid
CID 131572455
4-iodopyridine-3-carboxylic acid
CID 818279
4-fluoropyridine-3-carboxylic acid
CID 2762936
3-(1-sulfanylpropan-2-yl)pyridine-4-carboxylic acid
CID 135296132

Frequently Asked Questions

What is the IUPAC name of 3-trimethylsilylpyridine-4-carboxylic acid?
The IUPAC name of 3-trimethylsilylpyridine-4-carboxylic acid (CID 14673408) is 3-trimethylsilylpyridine-4-carboxylic acid.
What is the SMILES notation for 3-trimethylsilylpyridine-4-carboxylic acid?
The canonical SMILES for 3-trimethylsilylpyridine-4-carboxylic acid is C[Si](C)(C)c1cnccc1C(=O)O.
What is the InChIKey of 3-trimethylsilylpyridine-4-carboxylic acid?
The InChIKey is YMEDAHXDSBATCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2Si/c1-13(2,3)8-6-10-5-4-7(8)9(11)12/h4-6H,1-3H3,(H,11,12).
What are the key properties of 3-trimethylsilylpyridine-4-carboxylic acid?
3-trimethylsilylpyridine-4-carboxylic acid has a molecular weight of 195.29 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilylpyridine-4-carboxylic acid is sourced from PubChem (CID 14673408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).