2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

C11H15N5OS — CID 114263065

IUPAC2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide
SMILESCC(C)c1nn(C)cc1NC(=O)c1csc(N)n1
InChIInChI=1S/C11H15N5OS/c1-6(2)9-7(4-16(3)15-9)13-10(17)8-5-18-11(12)14-8/h4-6H,1-3H3,(H2,12,14)(H,13,17)
InChIKeySPYGXWHDHNENDR-UHFFFAOYSA-N
MW265.34 g/mol
LogP1.83
Rot. Bonds3

About 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide (PubChem CID 114263065) has the molecular formula C11H15N5OS and a molecular weight of 265.34 g/mol. Its IUPAC name is 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide
PubChem CID114263065
Molecular FormulaC11H15N5OS
Molecular Weight265.34 g/mol
Exact Mass265.10
IUPAC Name2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide
SMILESCC(C)c1nn(C)cc1NC(=O)c1csc(N)n1
InChIInChI=1S/C11H15N5OS/c1-6(2)9-7(4-16(3)15-9)13-10(17)8-5-18-11(12)14-8/h4-6H,1-3H3,(H2,12,14)(H,13,17)
InChIKeySPYGXWHDHNENDR-UHFFFAOYSA-N
XLogP1.83
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-bromo-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)thiophene-2-carboxamide
CID 114094705
2-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 55115833
methyl N-(1-methyl-3-propan-2-ylpyrazol-4-yl)carbamate
CID 130477952
5-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)hexanamide
CID 114263071
2-amino-N-(2,5-dichloro-4-methylphenyl)-1,3-thiazole-4-carboxamide
CID 113445874
2-amino-N-(2-chloro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 62789087
(2R)-2-[(1-methyl-3-propan-2-ylpyrazol-4-yl)carbamoylamino]propanoic acid
CID 114262609
2-amino-N-(5-chloro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 55116247
2-amino-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-1,3-thiazole-4-carboxamide
CID 62787171
2-(2-amino-1,3-thiazol-4-yl)-N-(1,3-dimethylpyrazol-4-yl)acetamide
CID 102805535
2-amino-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide
CID 62786815
2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 55116155

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide (CID 114263065) is 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide is CC(C)c1nn(C)cc1NC(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is SPYGXWHDHNENDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5OS/c1-6(2)9-7(4-16(3)15-9)13-10(17)8-5-18-11(12)14-8/h4-6H,1-3H3,(H2,12,14)(H,13,17).
What are the key properties of 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide?
2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 265.34 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 114263065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).