5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole

C9H13N3S — CID 155586619

IUPAC5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole
SMILESCCc1ccns1.Cc1ccn[nH]1
InChIInChI=1S/C5H7NS.C4H6N2/c1-2-5-3-4-6-7-5;1-4-2-3-5-6-4/h3-4H,2H2,1H3;2-3H,1H3,(H,5,6)
InChIKeyVYWSFQCSGSZWBT-UHFFFAOYSA-N
MW195.29 g/mol
LogP2.42
Rot. Bonds1

About 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole

5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole (PubChem CID 155586619) has the molecular formula C9H13N3S and a molecular weight of 195.29 g/mol. Its IUPAC name is 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole.

Molecular Properties

Compound Name5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole
PubChem CID155586619
Molecular FormulaC9H13N3S
Molecular Weight195.29 g/mol
Exact Mass195.08
IUPAC Name5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole
SMILESCCc1ccns1.Cc1ccn[nH]1
InChIInChI=1S/C5H7NS.C4H6N2/c1-2-5-3-4-6-7-5;1-4-2-3-5-6-4/h3-4H,2H2,1H3;2-3H,1H3,(H,5,6)
InChIKeyVYWSFQCSGSZWBT-UHFFFAOYSA-N
XLogP2.42
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole?
The IUPAC name of 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole (CID 155586619) is 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole.
What is the SMILES notation for 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole?
The canonical SMILES for 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole is CCc1ccns1.Cc1ccn[nH]1.
What is the InChIKey of 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole?
The InChIKey is VYWSFQCSGSZWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NS.C4H6N2/c1-2-5-3-4-6-7-5;1-4-2-3-5-6-4/h3-4H,2H2,1H3;2-3H,1H3,(H,5,6).
What are the key properties of 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole?
5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole has a molecular weight of 195.29 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1,2-thiazole;5-methyl-1H-pyrazole is sourced from PubChem (CID 155586619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).