1-(2-thiophen-2-ylethyl)pyrazol-3-amine

C9H11N3S — CID 63773628

IUPAC1-(2-thiophen-2-ylethyl)pyrazol-3-amine
SMILESNc1ccn(CCc2cccs2)n1
InChIInChI=1S/C9H11N3S/c10-9-4-6-12(11-9)5-3-8-2-1-7-13-8/h1-2,4,6-7H,3,5H2,(H2,10,11)
InChIKeyOUTUSZYAINYUCE-UHFFFAOYSA-N
MW193.28 g/mol
LogP1.77
Rot. Bonds3

About 1-(2-thiophen-2-ylethyl)pyrazol-3-amine

1-(2-thiophen-2-ylethyl)pyrazol-3-amine (PubChem CID 63773628) has the molecular formula C9H11N3S and a molecular weight of 193.28 g/mol. Its IUPAC name is 1-(2-thiophen-2-ylethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-thiophen-2-ylethyl)pyrazol-3-amine
PubChem CID63773628
Molecular FormulaC9H11N3S
Molecular Weight193.28 g/mol
Exact Mass193.07
IUPAC Name1-(2-thiophen-2-ylethyl)pyrazol-3-amine
SMILESNc1ccn(CCc2cccs2)n1
InChIInChI=1S/C9H11N3S/c10-9-4-6-12(11-9)5-3-8-2-1-7-13-8/h1-2,4,6-7H,3,5H2,(H2,10,11)
InChIKeyOUTUSZYAINYUCE-UHFFFAOYSA-N
XLogP1.77
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[methyl(1-thiophen-2-ylpropan-2-yl)amino]ethyl]pyrazol-3-amine
CID 79471004
1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine
CID 107109728
1-(3-thiophen-2-ylsulfanylpropyl)pyrazol-3-amine
CID 63311120
1-[1-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]ethanamine
CID 105359685
3-(3-aminopyrazol-1-yl)propan-1-ol
CID 50989707
1-(2-thiophen-2-ylethyl)tetrazol-5-amine
CID 79506694
[1-(2-thiophen-2-ylethyl)imidazol-4-yl]methanamine
CID 82470461
1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine
CID 82077522
2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine
CID 63773737
1-thiophen-2-ylpyrazol-3-amine
CID 70361976
2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]sulfanylethanamine
CID 94691066
2-methylsulfonyl-1-(2-thiophen-2-ylethyl)imidazole
CID 82132226

Frequently Asked Questions

What is the IUPAC name of 1-(2-thiophen-2-ylethyl)pyrazol-3-amine?
The IUPAC name of 1-(2-thiophen-2-ylethyl)pyrazol-3-amine (CID 63773628) is 1-(2-thiophen-2-ylethyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-thiophen-2-ylethyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-thiophen-2-ylethyl)pyrazol-3-amine is Nc1ccn(CCc2cccs2)n1.
What is the InChIKey of 1-(2-thiophen-2-ylethyl)pyrazol-3-amine?
The InChIKey is OUTUSZYAINYUCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S/c10-9-4-6-12(11-9)5-3-8-2-1-7-13-8/h1-2,4,6-7H,3,5H2,(H2,10,11).
What are the key properties of 1-(2-thiophen-2-ylethyl)pyrazol-3-amine?
1-(2-thiophen-2-ylethyl)pyrazol-3-amine has a molecular weight of 193.28 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-thiophen-2-ylethyl)pyrazol-3-amine is sourced from PubChem (CID 63773628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).