5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide

C10H16ClNO2SSi — CID 174351962

IUPAC5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide
SMILESCCONC(=O)c1sc(Cl)cc1[Si](C)(C)C
InChIInChI=1S/C10H16ClNO2SSi/c1-5-14-12-10(13)9-7(16(2,3)4)6-8(11)15-9/h6H,5H2,1-4H3,(H,12,13)
InChIKeyXCHVOGUWOJCYDE-UHFFFAOYSA-N
MW277.85 g/mol
LogP2.63
Rot. Bonds4

About 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide

5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide (PubChem CID 174351962) has the molecular formula C10H16ClNO2SSi and a molecular weight of 277.85 g/mol. Its IUPAC name is 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide
PubChem CID174351962
Molecular FormulaC10H16ClNO2SSi
Molecular Weight277.85 g/mol
Exact Mass277.04
IUPAC Name5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide
SMILESCCONC(=O)c1sc(Cl)cc1[Si](C)(C)C
InChIInChI=1S/C10H16ClNO2SSi/c1-5-14-12-10(13)9-7(16(2,3)4)6-8(11)15-9/h6H,5H2,1-4H3,(H,12,13)
InChIKeyXCHVOGUWOJCYDE-UHFFFAOYSA-N
XLogP2.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.85
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide (CID 174351962) is 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide is CCONC(=O)c1sc(Cl)cc1[Si](C)(C)C.
What is the InChIKey of 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide?
The InChIKey is XCHVOGUWOJCYDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClNO2SSi/c1-5-14-12-10(13)9-7(16(2,3)4)6-8(11)15-9/h6H,5H2,1-4H3,(H,12,13).
What are the key properties of 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide?
5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide has a molecular weight of 277.85 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethoxy-3-trimethylsilylthiophene-2-carboxamide is sourced from PubChem (CID 174351962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).