4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine

C8H10N4S — CID 6485390

IUPAC4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine
SMILESCc1nn(C)cc1-c1csc(N)n1
InChIInChI=1S/C8H10N4S/c1-5-6(3-12(2)11-5)7-4-13-8(9)10-7/h3-4H,1-2H3,(H2,9,10)
InChIKeyBAZMMNWMHWSUPN-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.43
Rot. Bonds1

About 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine

4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine (PubChem CID 6485390) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine
PubChem CID6485390
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC Name4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine
SMILESCc1nn(C)cc1-c1csc(N)n1
InChIInChI=1S/C8H10N4S/c1-5-6(3-12(2)11-5)7-4-13-8(9)10-7/h3-4H,1-2H3,(H2,9,10)
InChIKeyBAZMMNWMHWSUPN-UHFFFAOYSA-N
XLogP1.43
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine (CID 6485390) is 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine is Cc1nn(C)cc1-c1csc(N)n1.
What is the InChIKey of 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine?
The InChIKey is BAZMMNWMHWSUPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c1-5-6(3-12(2)11-5)7-4-13-8(9)10-7/h3-4H,1-2H3,(H2,9,10).
What are the key properties of 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine?
4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine has a molecular weight of 194.26 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dimethylpyrazol-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 6485390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).