2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide

C10H12N4OS — CID 47426149

IUPAC2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide
SMILESCCc1ncc(C(=O)Nc2ccn(C)n2)s1
InChIInChI=1S/C10H12N4OS/c1-3-9-11-6-7(16-9)10(15)12-8-4-5-14(2)13-8/h4-6H,3H2,1-2H3,(H,12,13,15)
InChIKeyVBTCKGIDCJIDBL-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.69
Rot. Bonds3

About 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide

2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide (PubChem CID 47426149) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide
PubChem CID47426149
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide
SMILESCCc1ncc(C(=O)Nc2ccn(C)n2)s1
InChIInChI=1S/C10H12N4OS/c1-3-9-11-6-7(16-9)10(15)12-8-4-5-14(2)13-8/h4-6H,3H2,1-2H3,(H,12,13,15)
InChIKeyVBTCKGIDCJIDBL-UHFFFAOYSA-N
XLogP1.69
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 3-[(2-ethyl-1,3-thiazole-5-carbonyl)amino]thiophene-2-carboxylate
CID 86847514
N-(1-methylpyrazol-3-yl)-5-nitrothiophene-2-carboxamide
CID 16796460
N-[5-chloro-4-(trifluoromethyl)-2-pyridinyl]-2-ethyl-1,3-thiazole-5-carboxamide
CID 89433948
N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide
CID 47425777
6-(ethylamino)-N-(1-methylpyrazol-3-yl)pyridazine-3-carboxamide
CID 62180741
5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 63722688
2-ethyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide
CID 47426169
2-ethyl-N-(2-methylbutan-2-yl)-1,3-thiazole-5-carboxamide
CID 48571573
1,3-dimethyl-N-(1-methylpyrazol-3-yl)pyrazole-4-carboxamide
CID 19474955
5-(methylamino)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 104640352
2-ethyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide
CID 89433950
N-(3-acetamido-4-methylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide
CID 48577750

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide (CID 47426149) is 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide is CCc1ncc(C(=O)Nc2ccn(C)n2)s1.
What is the InChIKey of 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is VBTCKGIDCJIDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-3-9-11-6-7(16-9)10(15)12-8-4-5-14(2)13-8/h4-6H,3H2,1-2H3,(H,12,13,15).
What are the key properties of 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide?
2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 236.30 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1-methylpyrazol-3-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 47426149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).