4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide

C10H11N3OS — CID 118441510

IUPAC4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2cnn(C)c2)c1
InChIInChI=1S/C10H11N3OS/c1-7-3-9(15-6-7)10(14)12-8-4-11-13(2)5-8/h3-6H,1-2H3,(H,12,14)
InChIKeyGLLFCDZFELXOQC-UHFFFAOYSA-N
MW221.29 g/mol
LogP2.04
Rot. Bonds2

About 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide

4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide (PubChem CID 118441510) has the molecular formula C10H11N3OS and a molecular weight of 221.29 g/mol. Its IUPAC name is 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide
PubChem CID118441510
Molecular FormulaC10H11N3OS
Molecular Weight221.29 g/mol
Exact Mass221.06
IUPAC Name4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2cnn(C)c2)c1
InChIInChI=1S/C10H11N3OS/c1-7-3-9(15-6-7)10(14)12-8-4-11-13(2)5-8/h3-6H,1-2H3,(H,12,14)
InChIKeyGLLFCDZFELXOQC-UHFFFAOYSA-N
XLogP2.04
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide?
The IUPAC name of 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide (CID 118441510) is 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide.
What is the SMILES notation for 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide?
The canonical SMILES for 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide is Cc1csc(C(=O)Nc2cnn(C)c2)c1.
What is the InChIKey of 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide?
The InChIKey is GLLFCDZFELXOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-7-3-9(15-6-7)10(14)12-8-4-11-13(2)5-8/h3-6H,1-2H3,(H,12,14).
What are the key properties of 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide?
4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide has a molecular weight of 221.29 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-methylpyrazol-4-yl)thiophene-2-carboxamide is sourced from PubChem (CID 118441510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).