(2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone

C10H11N3OS — CID 130964926

IUPAC(2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone
SMILESCc1cc(C(=O)c2csc(C)n2)n(C)n1
InChIInChI=1S/C10H11N3OS/c1-6-4-9(13(3)12-6)10(14)8-5-15-7(2)11-8/h4-5H,1-3H3
InChIKeyNRYXFWKTVZCWTH-UHFFFAOYSA-N
MW221.28 g/mol
LogP1.72
Rot. Bonds2

About (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone

(2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone (PubChem CID 130964926) has the molecular formula C10H11N3OS and a molecular weight of 221.28 g/mol. Its IUPAC name is (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone.

Molecular Properties

Compound Name(2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone
PubChem CID130964926
Molecular FormulaC10H11N3OS
Molecular Weight221.28 g/mol
Exact Mass221.06
IUPAC Name(2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone
SMILESCc1cc(C(=O)c2csc(C)n2)n(C)n1
InChIInChI=1S/C10H11N3OS/c1-6-4-9(13(3)12-6)10(14)8-5-15-7(2)11-8/h4-5H,1-3H3
InChIKeyNRYXFWKTVZCWTH-UHFFFAOYSA-N
XLogP1.72
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2,5-dimethylpyrazol-3-yl)-(2-methyltriazol-4-yl)methanone
CID 130603519
ethyl 2-[(2,5-dimethylpyrazole-3-carbonyl)amino]-1,3-thiazole-4-carboxylate
CID 16952741
2,5-dimethylpyrazole-3-carboxamide;hydrochloride
CID 68886245
(3,4-dimethylphenyl)-(2,5-dimethylpyrazol-3-yl)methanone
CID 105093552
2,5-dimethyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 16952767
(2-methyl-1,3-thiazol-4-yl)-pyrimidin-5-ylmethanone
CID 105085451
(2,5-dimethylpyrazol-3-yl)-(1-methylpyrazol-4-yl)methanone
CID 105082301
(3-methylphenyl)-(2-methyl-1,3-thiazol-4-yl)methanone
CID 105079306
[(3aR,8aS)-6-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,3,3a,4,5,7,8,8a-octahydropyrrolo[3,4-d]azepin-2-yl]-(2,5-dimethylpyrazol-3-yl)methanone
CID 155877378
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,5-dimethylpyrazole-3-carboxamide
CID 16809683
(2,5-dichlorophenyl)-(2,5-dimethylpyrazol-3-yl)methanone
CID 105095285
2-(aminomethyl)-N-(2,5-dimethylpyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 66378376

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone?
The IUPAC name of (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone (CID 130964926) is (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone.
What is the SMILES notation for (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone?
The canonical SMILES for (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone is Cc1cc(C(=O)c2csc(C)n2)n(C)n1.
What is the InChIKey of (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone?
The InChIKey is NRYXFWKTVZCWTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-6-4-9(13(3)12-6)10(14)8-5-15-7(2)11-8/h4-5H,1-3H3.
What are the key properties of (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone?
(2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone has a molecular weight of 221.28 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylpyrazol-3-yl)-(2-methyl-1,3-thiazol-4-yl)methanone is sourced from PubChem (CID 130964926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).