Silthiofam-des(trimethylsilyl)

C10H13NOS — CID 84557985

IUPAC4,5-dimethyl-N-prop-2-enylthiophene-3-carboxamide
SMILESCC1=C(SC=C1C(=O)NCC=C)C
InChIInChI=1S/C10H13NOS/c1-4-5-11-10(12)9-6-13-8(3)7(9)2/h4,6H,1,5H2,2-3H3,(H,11,12)
InChIKeyDGCYKBAFUIYUEX-UHFFFAOYSA-N
MW195.28 g/mol
LogP2.30
Rot. Bonds3

About Silthiofam-des(trimethylsilyl)

Silthiofam-des(trimethylsilyl) (PubChem CID 84557985) has the molecular formula C10H13NOS and a molecular weight of 195.28 g/mol. Its IUPAC name is 4,5-dimethyl-N-prop-2-enylthiophene-3-carboxamide.

Molecular Properties

Compound NameSilthiofam-des(trimethylsilyl)
PubChem CID84557985
Molecular FormulaC10H13NOS
Molecular Weight195.28 g/mol
Exact Mass195.07
IUPAC Name4,5-dimethyl-N-prop-2-enylthiophene-3-carboxamide
SMILESCC1=C(SC=C1C(=O)NCC=C)C
InChIInChI=1S/C10H13NOS/c1-4-5-11-10(12)9-6-13-8(3)7(9)2/h4,6H,1,5H2,2-3H3,(H,11,12)
InChIKeyDGCYKBAFUIYUEX-UHFFFAOYSA-N
XLogP2.30
TPSA57.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity205

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of Silthiofam-des(trimethylsilyl)?
The IUPAC name of Silthiofam-des(trimethylsilyl) (CID 84557985) is 4,5-dimethyl-N-prop-2-enylthiophene-3-carboxamide.
What is the SMILES notation for Silthiofam-des(trimethylsilyl)?
The canonical SMILES for Silthiofam-des(trimethylsilyl) is CC1=C(SC=C1C(=O)NCC=C)C.
What is the InChIKey of Silthiofam-des(trimethylsilyl)?
The InChIKey is DGCYKBAFUIYUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NOS/c1-4-5-11-10(12)9-6-13-8(3)7(9)2/h4,6H,1,5H2,2-3H3,(H,11,12).
What are the key properties of Silthiofam-des(trimethylsilyl)?
Silthiofam-des(trimethylsilyl) has a molecular weight of 195.28 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Silthiofam-des(trimethylsilyl) is sourced from PubChem (CID 84557985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).