2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine

C8H10N4S — CID 69030660

IUPAC2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine
SMILESNCCc1csc(-c2ccn[nH]2)n1
InChIInChI=1S/C8H10N4S/c9-3-1-6-5-13-8(11-6)7-2-4-10-12-7/h2,4-5H,1,3,9H2,(H,10,12)
InChIKeyHUWZZNRXEDQKTK-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.03
Rot. Bonds3

About 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine

2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine (PubChem CID 69030660) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine
PubChem CID69030660
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC Name2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine
SMILESNCCc1csc(-c2ccn[nH]2)n1
InChIInChI=1S/C8H10N4S/c9-3-1-6-5-13-8(11-6)7-2-4-10-12-7/h2,4-5H,1,3,9H2,(H,10,12)
InChIKeyHUWZZNRXEDQKTK-UHFFFAOYSA-N
XLogP1.03
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine?
The IUPAC name of 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine (CID 69030660) is 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine.
What is the SMILES notation for 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine?
The canonical SMILES for 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine is NCCc1csc(-c2ccn[nH]2)n1.
What is the InChIKey of 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine?
The InChIKey is HUWZZNRXEDQKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c9-3-1-6-5-13-8(11-6)7-2-4-10-12-7/h2,4-5H,1,3,9H2,(H,10,12).
What are the key properties of 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine?
2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine has a molecular weight of 194.26 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1H-pyrazol-5-yl)-1,3-thiazol-4-yl]ethanamine is sourced from PubChem (CID 69030660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).