7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide

C11H9N5OS — CID 19620217

IUPAC7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide
SMILESNNC(=O)c1cc2nccc(-c3cccs3)n2n1
InChIInChI=1S/C11H9N5OS/c12-14-11(17)7-6-10-13-4-3-8(16(10)15-7)9-2-1-5-18-9/h1-6H,12H2,(H,14,17)
InChIKeyZZVCOLLBQBIXTG-UHFFFAOYSA-N
MW259.29 g/mol
LogP1.06
Rot. Bonds2

About 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide

7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide (PubChem CID 19620217) has the molecular formula C11H9N5OS and a molecular weight of 259.29 g/mol. Its IUPAC name is 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide.

Molecular Properties

Compound Name7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide
PubChem CID19620217
Molecular FormulaC11H9N5OS
Molecular Weight259.29 g/mol
Exact Mass259.05
IUPAC Name7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide
SMILESNNC(=O)c1cc2nccc(-c3cccs3)n2n1
InChIInChI=1S/C11H9N5OS/c12-14-11(17)7-6-10-13-4-3-8(16(10)15-7)9-2-1-5-18-9/h1-6H,12H2,(H,14,17)
InChIKeyZZVCOLLBQBIXTG-UHFFFAOYSA-N
XLogP1.06
TPSA85.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.29
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(3,5-dichlorophenyl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19590478
N-(1H-indazol-6-yl)-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19615840
2,3-dihydroindol-1-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)methanone
CID 19615898
7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbohydrazide
CID 19620200
N-(7-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)propanamide
CID 58894131
7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 7016450
imidazo[1,2-c]pyrimidine-7-carbohydrazide
CID 141316614
(2-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)methanamine
CID 103316839
5-[(2-thiophen-2-ylimidazol-1-yl)methyl]-1,2-oxazole-3-carbohydrazide
CID 63582424
N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 163264403
N-benzyl-7-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 4866947
N-(2-fluorophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 167400677

Frequently Asked Questions

What is the IUPAC name of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide?
The IUPAC name of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide (CID 19620217) is 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide.
What is the SMILES notation for 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide?
The canonical SMILES for 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide is NNC(=O)c1cc2nccc(-c3cccs3)n2n1.
What is the InChIKey of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide?
The InChIKey is ZZVCOLLBQBIXTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5OS/c12-14-11(17)7-6-10-13-4-3-8(16(10)15-7)9-2-1-5-18-9/h1-6H,12H2,(H,14,17).
What are the key properties of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide?
7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide has a molecular weight of 259.29 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbohydrazide is sourced from PubChem (CID 19620217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).