N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine

C8H9N3S — CID 67516220

IUPACN-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine
SMILESc1csc(CNc2ccn[nH]2)c1
InChIInChI=1S/C8H9N3S/c1-2-7(12-5-1)6-9-8-3-4-10-11-8/h1-5H,6H2,(H2,9,10,11)
InChIKeyOSEVYAQLAPTMCT-UHFFFAOYSA-N
MW179.25 g/mol
LogP2.08
Rot. Bonds3

About N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine

N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine (PubChem CID 67516220) has the molecular formula C8H9N3S and a molecular weight of 179.25 g/mol. Its IUPAC name is N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound NameN-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine
PubChem CID67516220
Molecular FormulaC8H9N3S
Molecular Weight179.25 g/mol
Exact Mass179.05
IUPAC NameN-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine
SMILESc1csc(CNc2ccn[nH]2)c1
InChIInChI=1S/C8H9N3S/c1-2-7(12-5-1)6-9-8-3-4-10-11-8/h1-5H,6H2,(H2,9,10,11)
InChIKeyOSEVYAQLAPTMCT-UHFFFAOYSA-N
XLogP2.08
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.25
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(thiophen-2-ylmethyl)-1H-pyrazol-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 N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine?
The IUPAC name of N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine (CID 67516220) is N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine.
What is the SMILES notation for N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine?
The canonical SMILES for N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine is c1csc(CNc2ccn[nH]2)c1.
What is the InChIKey of N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine?
The InChIKey is OSEVYAQLAPTMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3S/c1-2-7(12-5-1)6-9-8-3-4-10-11-8/h1-5H,6H2,(H2,9,10,11).
What are the key properties of N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine?
N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine has a molecular weight of 179.25 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiophen-2-ylmethyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 67516220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).