4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine

C9H12N4S — CID 6485391

IUPAC4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine
SMILESCCn1ncc(-c2csc(N)n2)c1C
InChIInChI=1S/C9H12N4S/c1-3-13-6(2)7(4-11-13)8-5-14-9(10)12-8/h4-5H,3H2,1-2H3,(H2,10,12)
InChIKeyLHBGSPNAUKTQJY-UHFFFAOYSA-N
MW208.29 g/mol
LogP1.92
Rot. Bonds2

About 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine

4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine (PubChem CID 6485391) has the molecular formula C9H12N4S and a molecular weight of 208.29 g/mol. Its IUPAC name is 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine
PubChem CID6485391
Molecular FormulaC9H12N4S
Molecular Weight208.29 g/mol
Exact Mass208.08
IUPAC Name4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine
SMILESCCn1ncc(-c2csc(N)n2)c1C
InChIInChI=1S/C9H12N4S/c1-3-13-6(2)7(4-11-13)8-5-14-9(10)12-8/h4-5H,3H2,1-2H3,(H2,10,12)
InChIKeyLHBGSPNAUKTQJY-UHFFFAOYSA-N
XLogP1.92
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1,5-Dimethyl-1H-pyrazol-4-yl)-thiazol-2-ylamine
CID 6485377
4-(1,3-dimethyl-1H-pyrazol-4-yl)-1,3-thiazol-2-amine
CID 6485390
4-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-thiazol-2-ylamine
CID 6485376
4-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazol-2-amine
CID 6485389
N-Methyl-4-(5-methyl-1-phenyl-1H-pyrazol-4-yl)-2-thiazolamine
CID 59088603
4-methyl-5-(1-methyl-1H-pyrazol-3-yl)-N-(2,3,6-trifluorobenzyl)-1,3-thiazol-2-amine
CID 26343224
4-(1,3-dimethylpyrazol-4-yl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine
CID 53604217
1-[4-(1,3-Dimethylpyrazol-4-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine
CID 65197342
N-benzyl-4-methyl-5-(1-methyl-1H-pyrazol-3-yl)-1,3-thiazol-2-amine
CID 118755451
5-[1-(2-methoxyethyl)-1H-pyrazol-3-yl]-4-methyl-1,3-thiazol-2-amine
CID 118758993
4-methyl-5-[1-(1-methyl-4-piperidinyl)-1H-pyrazol-3-yl]-1,3-thiazol-2-amine bis(trifluoroacetate)
CID 118759330
4-methyl-5-[1-(pyridin-4-ylmethyl)-1H-pyrazol-3-yl]-1,3-thiazol-2-amine
CID 118759605

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine (CID 6485391) is 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine is CCn1ncc(-c2csc(N)n2)c1C.
What is the InChIKey of 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine?
The InChIKey is LHBGSPNAUKTQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4S/c1-3-13-6(2)7(4-11-13)8-5-14-9(10)12-8/h4-5H,3H2,1-2H3,(H2,10,12).
What are the key properties of 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine?
4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine has a molecular weight of 208.29 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyl-5-methylpyrazol-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 6485391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).