1-thiophen-3-ylpyrazol-4-amine

C7H7N3S — CID 66521556

IUPAC1-thiophen-3-ylpyrazol-4-amine
SMILESNc1cnn(-c2ccsc2)c1
InChIInChI=1S/C7H7N3S/c8-6-3-9-10(4-6)7-1-2-11-5-7/h1-5H,8H2
InChIKeyLKWRWRUETMHCQS-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.52
Rot. Bonds1

About 1-thiophen-3-ylpyrazol-4-amine

1-thiophen-3-ylpyrazol-4-amine (PubChem CID 66521556) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is 1-thiophen-3-ylpyrazol-4-amine.

Molecular Properties

Compound Name1-thiophen-3-ylpyrazol-4-amine
PubChem CID66521556
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Name1-thiophen-3-ylpyrazol-4-amine
SMILESNc1cnn(-c2ccsc2)c1
InChIInChI=1S/C7H7N3S/c8-6-3-9-10(4-6)7-1-2-11-5-7/h1-5H,8H2
InChIKeyLKWRWRUETMHCQS-UHFFFAOYSA-N
XLogP1.52
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-thienyl)pyrazole
CID 11480538
5-Iodo-1-(2-iodothiophen-3-yl)pyrazole
CID 53310186
1-Thiophen-3-ylpyrazole-4,5-diamine
CID 22062307
1-(4-Methylthiophen-3-yl)pyrazole
CID 68587491
2-(1H-pyrazol-1-yl)thiophen-3-amine
CID 68781723
2-(4-methyl-1H-pyrazol-1-yl)thiophen-3-amine
CID 68784506
1-Thiophen-3-ylpyrazole-3,4-diamine
CID 70317138
1-(5-Chlorothiophen-3-yl)pyrazole
CID 89311056
(1-Thiophen-3-yltriazol-4-yl)methanamine
CID 119106442
1-methyl-N-thiophen-2-ylpyrazol-4-amine
CID 141361572
1-ethyl-N-thiophen-2-ylpyrazol-4-amine
CID 141361582
3-Methyl-1-thiophen-3-ylpyrazole
CID 170026741

Frequently Asked Questions

What is the IUPAC name of 1-thiophen-3-ylpyrazol-4-amine?
The IUPAC name of 1-thiophen-3-ylpyrazol-4-amine (CID 66521556) is 1-thiophen-3-ylpyrazol-4-amine.
What is the SMILES notation for 1-thiophen-3-ylpyrazol-4-amine?
The canonical SMILES for 1-thiophen-3-ylpyrazol-4-amine is Nc1cnn(-c2ccsc2)c1.
What is the InChIKey of 1-thiophen-3-ylpyrazol-4-amine?
The InChIKey is LKWRWRUETMHCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c8-6-3-9-10(4-6)7-1-2-11-5-7/h1-5H,8H2.
What are the key properties of 1-thiophen-3-ylpyrazol-4-amine?
1-thiophen-3-ylpyrazol-4-amine has a molecular weight of 165.22 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-3-ylpyrazol-4-amine is sourced from PubChem (CID 66521556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).