5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine

C9H11N3S — CID 16653076

IUPAC5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(N)c1-c1cccs1
InChIInChI=1S/C9H11N3S/c1-2-6-8(9(10)12-11-6)7-4-3-5-13-7/h3-5H,2H2,1H3,(H3,10,11,12)
InChIKeyRTWOAIQGFKQEFY-UHFFFAOYSA-N
MW193.28 g/mol
LogP2.28
Rot. Bonds2

About 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine

5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine (PubChem CID 16653076) has the molecular formula C9H11N3S and a molecular weight of 193.28 g/mol. Its IUPAC name is 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine
PubChem CID16653076
Molecular FormulaC9H11N3S
Molecular Weight193.28 g/mol
Exact Mass193.07
IUPAC Name5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(N)c1-c1cccs1
InChIInChI=1S/C9H11N3S/c1-2-6-8(9(10)12-11-6)7-4-3-5-13-7/h3-5H,2H2,1H3,(H3,10,11,12)
InChIKeyRTWOAIQGFKQEFY-UHFFFAOYSA-N
XLogP2.28
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine (CID 16653076) is 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine is CCc1[nH]nc(N)c1-c1cccs1.
What is the InChIKey of 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine?
The InChIKey is RTWOAIQGFKQEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S/c1-2-6-8(9(10)12-11-6)7-4-3-5-13-7/h3-5H,2H2,1H3,(H3,10,11,12).
What are the key properties of 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine?
5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine has a molecular weight of 193.28 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 16653076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).