4-methylthiophene-3-carboxamide

C6H7NOS — CID 18938129

IUPAC4-methylthiophene-3-carboxamide
SMILESCc1cscc1C(N)=O
InChIInChI=1S/C6H7NOS/c1-4-2-9-3-5(4)6(7)8/h2-3H,1H3,(H2,7,8)
InChIKeyBMGPRFQPACSOQX-UHFFFAOYSA-N
MW141.19 g/mol
LogP1.16
Rot. Bonds1

About 4-methylthiophene-3-carboxamide

4-methylthiophene-3-carboxamide (PubChem CID 18938129) has the molecular formula C6H7NOS and a molecular weight of 141.19 g/mol. Its IUPAC name is 4-methylthiophene-3-carboxamide.

Molecular Properties

Compound Name4-methylthiophene-3-carboxamide
PubChem CID18938129
Molecular FormulaC6H7NOS
Molecular Weight141.19 g/mol
Exact Mass141.02
IUPAC Name4-methylthiophene-3-carboxamide
SMILESCc1cscc1C(N)=O
InChIInChI=1S/C6H7NOS/c1-4-2-9-3-5(4)6(7)8/h2-3H,1H3,(H2,7,8)
InChIKeyBMGPRFQPACSOQX-UHFFFAOYSA-N
XLogP1.16
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.19
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methylthiophene-3-carboxamide?
The IUPAC name of 4-methylthiophene-3-carboxamide (CID 18938129) is 4-methylthiophene-3-carboxamide.
What is the SMILES notation for 4-methylthiophene-3-carboxamide?
The canonical SMILES for 4-methylthiophene-3-carboxamide is Cc1cscc1C(N)=O.
What is the InChIKey of 4-methylthiophene-3-carboxamide?
The InChIKey is BMGPRFQPACSOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NOS/c1-4-2-9-3-5(4)6(7)8/h2-3H,1H3,(H2,7,8).
What are the key properties of 4-methylthiophene-3-carboxamide?
4-methylthiophene-3-carboxamide has a molecular weight of 141.19 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylthiophene-3-carboxamide is sourced from PubChem (CID 18938129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).