2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole

C10H13N3S — CID 65169099

IUPAC2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole
SMILESCc1cc(C)n(-c2nc(C)c(C)s2)n1
InChIInChI=1S/C10H13N3S/c1-6-5-7(2)13(12-6)10-11-8(3)9(4)14-10/h5H,1-4H3
InChIKeyYXWIBFOPEZACOD-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.56
Rot. Bonds1

About 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole

2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole (PubChem CID 65169099) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole
PubChem CID65169099
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole
SMILESCc1cc(C)n(-c2nc(C)c(C)s2)n1
InChIInChI=1S/C10H13N3S/c1-6-5-7(2)13(12-6)10-11-8(3)9(4)14-10/h5H,1-4H3
InChIKeyYXWIBFOPEZACOD-UHFFFAOYSA-N
XLogP2.56
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole (CID 65169099) is 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole is Cc1cc(C)n(-c2nc(C)c(C)s2)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole?
The InChIKey is YXWIBFOPEZACOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-6-5-7(2)13(12-6)10-11-8(3)9(4)14-10/h5H,1-4H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole?
2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole has a molecular weight of 207.30 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-1,3-thiazole is sourced from PubChem (CID 65169099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).