N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide

C13H11N5OS — CID 155913126

IUPACN-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESCn1nc(-c2ccccn2)cc1NC(=O)c1cscn1
InChIInChI=1S/C13H11N5OS/c1-18-12(16-13(19)11-7-20-8-15-11)6-10(17-18)9-4-2-3-5-14-9/h2-8H,1H3,(H,16,19)
InChIKeyCBVZIKNMIOLKNT-UHFFFAOYSA-N
MW285.33 g/mol
LogP2.19
Rot. Bonds3

About N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide

N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide (PubChem CID 155913126) has the molecular formula C13H11N5OS and a molecular weight of 285.33 g/mol. Its IUPAC name is N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide
PubChem CID155913126
Molecular FormulaC13H11N5OS
Molecular Weight285.33 g/mol
Exact Mass285.07
IUPAC NameN-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESCn1nc(-c2ccccn2)cc1NC(=O)c1cscn1
InChIInChI=1S/C13H11N5OS/c1-18-12(16-13(19)11-7-20-8-15-11)6-10(17-18)9-4-2-3-5-14-9/h2-8H,1H3,(H,16,19)
InChIKeyCBVZIKNMIOLKNT-UHFFFAOYSA-N
XLogP2.19
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1H-indazole-3-carboxamide
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N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-2-(4-pyrimidin-2-ylpyrazol-1-yl)acetamide
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N-phenyl-1,3-thiazole-4-carboxamide
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N-[1-(2-hydroxyethyl)-3-thiophen-2-ylpyrazol-5-yl]-1,3-thiazole-4-carboxamide
CID 110932034
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N-(2-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 62046847
N-(2,6-dimethylphenyl)-1,3-thiazole-4-carboxamide
CID 62045312
N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-3-(4-oxoquinazolin-3-yl)propanamide
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CID 62046507

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide (CID 155913126) is N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide is Cn1nc(-c2ccccn2)cc1NC(=O)c1cscn1.
What is the InChIKey of N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is CBVZIKNMIOLKNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5OS/c1-18-12(16-13(19)11-7-20-8-15-11)6-10(17-18)9-4-2-3-5-14-9/h2-8H,1H3,(H,16,19).
What are the key properties of N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide?
N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 285.33 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-3-pyridin-2-ylpyrazol-5-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 155913126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).