2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine

C10H14N4S — CID 61376066

IUPAC2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine
SMILESCCCn1c(C)nnc1-c1sccc1N
InChIInChI=1S/C10H14N4S/c1-3-5-14-7(2)12-13-10(14)9-8(11)4-6-15-9/h4,6H,3,5,11H2,1-2H3
InChIKeyGWOBYXPAPUVGAJ-UHFFFAOYSA-N
MW222.32 g/mol
LogP2.31
Rot. Bonds3

About 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine

2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine (PubChem CID 61376066) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine.

Molecular Properties

Compound Name2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine
PubChem CID61376066
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine
SMILESCCCn1c(C)nnc1-c1sccc1N
InChIInChI=1S/C10H14N4S/c1-3-5-14-7(2)12-13-10(14)9-8(11)4-6-15-9/h4,6H,3,5,11H2,1-2H3
InChIKeyGWOBYXPAPUVGAJ-UHFFFAOYSA-N
XLogP2.31
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-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 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine?
The IUPAC name of 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine (CID 61376066) is 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine.
What is the SMILES notation for 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine?
The canonical SMILES for 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine is CCCn1c(C)nnc1-c1sccc1N.
What is the InChIKey of 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine?
The InChIKey is GWOBYXPAPUVGAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-3-5-14-7(2)12-13-10(14)9-8(11)4-6-15-9/h4,6H,3,5,11H2,1-2H3.
What are the key properties of 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine?
2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine has a molecular weight of 222.32 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-4-propyl-1,2,4-triazol-3-yl)thiophen-3-amine is sourced from PubChem (CID 61376066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).