1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine

C12H11N3S2 — CID 62501208

IUPAC1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine
SMILESCn1nc(-c2ccsc2)c(-c2cccs2)c1N
InChIInChI=1S/C12H11N3S2/c1-15-12(13)10(9-3-2-5-17-9)11(14-15)8-4-6-16-7-8/h2-7H,13H2,1H3
InChIKeyYKIXODMCTFDYDI-UHFFFAOYSA-N
MW261.38 g/mol
LogP3.46
Rot. Bonds2

About 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine

1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine (PubChem CID 62501208) has the molecular formula C12H11N3S2 and a molecular weight of 261.38 g/mol. Its IUPAC name is 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine
PubChem CID62501208
Molecular FormulaC12H11N3S2
Molecular Weight261.38 g/mol
Exact Mass261.04
IUPAC Name1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine
SMILESCn1nc(-c2ccsc2)c(-c2cccs2)c1N
InChIInChI=1S/C12H11N3S2/c1-15-12(13)10(9-3-2-5-17-9)11(14-15)8-4-6-16-7-8/h2-7H,13H2,1H3
InChIKeyYKIXODMCTFDYDI-UHFFFAOYSA-N
XLogP3.46
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine?
The IUPAC name of 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine (CID 62501208) is 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine.
What is the SMILES notation for 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine?
The canonical SMILES for 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine is Cn1nc(-c2ccsc2)c(-c2cccs2)c1N.
What is the InChIKey of 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine?
The InChIKey is YKIXODMCTFDYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3S2/c1-15-12(13)10(9-3-2-5-17-9)11(14-15)8-4-6-16-7-8/h2-7H,13H2,1H3.
What are the key properties of 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine?
1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine has a molecular weight of 261.38 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-thiophen-2-yl-3-thiophen-3-ylpyrazol-5-amine is sourced from PubChem (CID 62501208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).