1-thiophen-3-ylpyrazole

C7H6N2S — CID 11480538

IUPAC1-thiophen-3-ylpyrazole
SMILESc1cnn(-c2ccsc2)c1
InChIInChI=1S/C7H6N2S/c1-3-8-9(4-1)7-2-5-10-6-7/h1-6H
InChIKeyFDWUSGJFFWUURT-UHFFFAOYSA-N
MW150.21 g/mol
LogP1.93
Rot. Bonds1

About 1-thiophen-3-ylpyrazole

1-thiophen-3-ylpyrazole (PubChem CID 11480538) has the molecular formula C7H6N2S and a molecular weight of 150.21 g/mol. Its IUPAC name is 1-thiophen-3-ylpyrazole.

Molecular Properties

Compound Name1-thiophen-3-ylpyrazole
PubChem CID11480538
Molecular FormulaC7H6N2S
Molecular Weight150.21 g/mol
Exact Mass150.03
IUPAC Name1-thiophen-3-ylpyrazole
SMILESc1cnn(-c2ccsc2)c1
InChIInChI=1S/C7H6N2S/c1-3-8-9(4-1)7-2-5-10-6-7/h1-6H
InChIKeyFDWUSGJFFWUURT-UHFFFAOYSA-N
XLogP1.93
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.21
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-thiophen-3-ylpyrazole?
The IUPAC name of 1-thiophen-3-ylpyrazole (CID 11480538) is 1-thiophen-3-ylpyrazole.
What is the SMILES notation for 1-thiophen-3-ylpyrazole?
The canonical SMILES for 1-thiophen-3-ylpyrazole is c1cnn(-c2ccsc2)c1.
What is the InChIKey of 1-thiophen-3-ylpyrazole?
The InChIKey is FDWUSGJFFWUURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2S/c1-3-8-9(4-1)7-2-5-10-6-7/h1-6H.
What are the key properties of 1-thiophen-3-ylpyrazole?
1-thiophen-3-ylpyrazole has a molecular weight of 150.21 g/mol, XLogP of 1.93, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-3-ylpyrazole is sourced from PubChem (CID 11480538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).