3-ethylthiophene-2-carboxamide

C7H9NOS — CID 18938160

IUPAC3-ethylthiophene-2-carboxamide
SMILESCCc1ccsc1C(N)=O
InChIInChI=1S/C7H9NOS/c1-2-5-3-4-10-6(5)7(8)9/h3-4H,2H2,1H3,(H2,8,9)
InChIKeySKNSXXSGTWIJSL-UHFFFAOYSA-N
MW155.22 g/mol
LogP1.41
Rot. Bonds2

About 3-ethylthiophene-2-carboxamide

3-ethylthiophene-2-carboxamide (PubChem CID 18938160) has the molecular formula C7H9NOS and a molecular weight of 155.22 g/mol. Its IUPAC name is 3-ethylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-ethylthiophene-2-carboxamide
PubChem CID18938160
Molecular FormulaC7H9NOS
Molecular Weight155.22 g/mol
Exact Mass155.04
IUPAC Name3-ethylthiophene-2-carboxamide
SMILESCCc1ccsc1C(N)=O
InChIInChI=1S/C7H9NOS/c1-2-5-3-4-10-6(5)7(8)9/h3-4H,2H2,1H3,(H2,8,9)
InChIKeySKNSXXSGTWIJSL-UHFFFAOYSA-N
XLogP1.41
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethylthiophene-2-carboxamide?
The IUPAC name of 3-ethylthiophene-2-carboxamide (CID 18938160) is 3-ethylthiophene-2-carboxamide.
What is the SMILES notation for 3-ethylthiophene-2-carboxamide?
The canonical SMILES for 3-ethylthiophene-2-carboxamide is CCc1ccsc1C(N)=O.
What is the InChIKey of 3-ethylthiophene-2-carboxamide?
The InChIKey is SKNSXXSGTWIJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NOS/c1-2-5-3-4-10-6(5)7(8)9/h3-4H,2H2,1H3,(H2,8,9).
What are the key properties of 3-ethylthiophene-2-carboxamide?
3-ethylthiophene-2-carboxamide has a molecular weight of 155.22 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylthiophene-2-carboxamide is sourced from PubChem (CID 18938160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).