5-thiophen-2-yl-1H-pyrazol-3-amine

C7H7N3S — CID 523184

IUPAC5-thiophen-2-yl-1H-pyrazol-3-amine
SMILESNc1cc(-c2cccs2)[nH]n1
InChIInChI=1S/C7H7N3S/c8-7-4-5(9-10-7)6-2-1-3-11-6/h1-4H,(H3,8,9,10)
InChIKeyTXSOLYKLZBJHFF-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.72
Rot. Bonds1

About 5-thiophen-2-yl-1H-pyrazol-3-amine

5-thiophen-2-yl-1H-pyrazol-3-amine (PubChem CID 523184) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is 5-thiophen-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-thiophen-2-yl-1H-pyrazol-3-amine
PubChem CID523184
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Name5-thiophen-2-yl-1H-pyrazol-3-amine
SMILESNc1cc(-c2cccs2)[nH]n1
InChIInChI=1S/C7H7N3S/c8-7-4-5(9-10-7)6-2-1-3-11-6/h1-4H,(H3,8,9,10)
InChIKeyTXSOLYKLZBJHFF-UHFFFAOYSA-N
XLogP1.72
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-thiophen-2-yl-1H-pyrazol-3-amine (CID 523184) is 5-thiophen-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-thiophen-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-thiophen-2-yl-1H-pyrazol-3-amine is Nc1cc(-c2cccs2)[nH]n1.
What is the InChIKey of 5-thiophen-2-yl-1H-pyrazol-3-amine?
The InChIKey is TXSOLYKLZBJHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c8-7-4-5(9-10-7)6-2-1-3-11-6/h1-4H,(H3,8,9,10).
What are the key properties of 5-thiophen-2-yl-1H-pyrazol-3-amine?
5-thiophen-2-yl-1H-pyrazol-3-amine has a molecular weight of 165.22 g/mol, XLogP of 1.72, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 523184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).