5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine

C8H10N4S — CID 165472618

IUPAC5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine
SMILESCc1cc(N)nn1Cc1ccns1
InChIInChI=1S/C8H10N4S/c1-6-4-8(9)11-12(6)5-7-2-3-10-13-7/h2-4H,5H2,1H3,(H2,9,11)
InChIKeyHLFZVVFYNFYXHZ-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.28
Rot. Bonds2

About 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine

5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine (PubChem CID 165472618) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine
PubChem CID165472618
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC Name5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine
SMILESCc1cc(N)nn1Cc1ccns1
InChIInChI=1S/C8H10N4S/c1-6-4-8(9)11-12(6)5-7-2-3-10-13-7/h2-4H,5H2,1H3,(H2,9,11)
InChIKeyHLFZVVFYNFYXHZ-UHFFFAOYSA-N
XLogP1.28
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine?
The IUPAC name of 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine (CID 165472618) is 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine.
What is the SMILES notation for 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine?
The canonical SMILES for 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine is Cc1cc(N)nn1Cc1ccns1.
What is the InChIKey of 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine?
The InChIKey is HLFZVVFYNFYXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c1-6-4-8(9)11-12(6)5-7-2-3-10-13-7/h2-4H,5H2,1H3,(H2,9,11).
What are the key properties of 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine?
5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine has a molecular weight of 194.26 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(1,2-thiazol-5-ylmethyl)pyrazol-3-amine is sourced from PubChem (CID 165472618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).