3-ethenylthiophene-2-carboxamide

C7H7NOS — CID 134954198

IUPAC3-ethenylthiophene-2-carboxamide
SMILESC=Cc1ccsc1C(N)=O
InChIInChI=1S/C7H7NOS/c1-2-5-3-4-10-6(5)7(8)9/h2-4H,1H2,(H2,8,9)
InChIKeyWDMSFKDONZXATF-UHFFFAOYSA-N
MW153.21 g/mol
LogP1.49
Rot. Bonds2

About 3-ethenylthiophene-2-carboxamide

3-ethenylthiophene-2-carboxamide (PubChem CID 134954198) has the molecular formula C7H7NOS and a molecular weight of 153.21 g/mol. Its IUPAC name is 3-ethenylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-ethenylthiophene-2-carboxamide
PubChem CID134954198
Molecular FormulaC7H7NOS
Molecular Weight153.21 g/mol
Exact Mass153.02
IUPAC Name3-ethenylthiophene-2-carboxamide
SMILESC=Cc1ccsc1C(N)=O
InChIInChI=1S/C7H7NOS/c1-2-5-3-4-10-6(5)7(8)9/h2-4H,1H2,(H2,8,9)
InChIKeyWDMSFKDONZXATF-UHFFFAOYSA-N
XLogP1.49
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.21
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 22063
CID 22063
CID 239511
CID 239511
CID 22374565
CID 22374565
CID 2760084
CID 2760084
CID 73098
CID 73098
CID 4983386
CID 4983386
CID 2808088
CID 2808088
CID 2808207
CID 2808207
CID 21837037
CID 21837037
CID 819552
CID 819552
CID 588128
CID 588128
CID 2795529
CID 2795529

Frequently Asked Questions

What is the IUPAC name of 3-ethenylthiophene-2-carboxamide?
The IUPAC name of 3-ethenylthiophene-2-carboxamide (CID 134954198) is 3-ethenylthiophene-2-carboxamide.
What is the SMILES notation for 3-ethenylthiophene-2-carboxamide?
The canonical SMILES for 3-ethenylthiophene-2-carboxamide is C=Cc1ccsc1C(N)=O.
What is the InChIKey of 3-ethenylthiophene-2-carboxamide?
The InChIKey is WDMSFKDONZXATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NOS/c1-2-5-3-4-10-6(5)7(8)9/h2-4H,1H2,(H2,8,9).
What are the key properties of 3-ethenylthiophene-2-carboxamide?
3-ethenylthiophene-2-carboxamide has a molecular weight of 153.21 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenylthiophene-2-carboxamide is sourced from PubChem (CID 134954198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).