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

C10H14N4S — CID 63616303

IUPAC5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine
SMILESCCc1cc(-c2ncnn2CC)c(N)s1
InChIInChI=1S/C10H14N4S/c1-3-7-5-8(9(11)15-7)10-12-6-13-14(10)4-2/h5-6H,3-4,11H2,1-2H3
InChIKeyUBHZFUPXTOIMGQ-UHFFFAOYSA-N
MW222.32 g/mol
LogP2.17
Rot. Bonds3

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

5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine (PubChem CID 63616303) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine.

Molecular Properties

Compound Name5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine
PubChem CID63616303
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine
SMILESCCc1cc(-c2ncnn2CC)c(N)s1
InChIInChI=1S/C10H14N4S/c1-3-7-5-8(9(11)15-7)10-12-6-13-14(10)4-2/h5-6H,3-4,11H2,1-2H3
InChIKeyUBHZFUPXTOIMGQ-UHFFFAOYSA-N
XLogP2.17
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 ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine?
The IUPAC name of 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine (CID 63616303) is 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine.
What is the SMILES notation for 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine?
The canonical SMILES for 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine is CCc1cc(-c2ncnn2CC)c(N)s1.
What is the InChIKey of 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine?
The InChIKey is UBHZFUPXTOIMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-3-7-5-8(9(11)15-7)10-12-6-13-14(10)4-2/h5-6H,3-4,11H2,1-2H3.
What are the key properties of 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine?
5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine has a molecular weight of 222.32 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(2-ethyl-1,2,4-triazol-3-yl)thiophen-2-amine is sourced from PubChem (CID 63616303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).