2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide

C10H9N5OS — CID 175759540

IUPAC2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
SMILESCn1cnc(-c2cn3ncc(C(N)=O)c3s2)c1
InChIInChI=1S/C10H9N5OS/c1-14-3-7(12-5-14)8-4-15-10(17-8)6(2-13-15)9(11)16/h2-5H,1H3,(H2,11,16)
InChIKeyUYRFPRNXIDNYKW-UHFFFAOYSA-N
MW247.28 g/mol
LogP0.90
Rot. Bonds2

About 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide

2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide (PubChem CID 175759540) has the molecular formula C10H9N5OS and a molecular weight of 247.28 g/mol. Its IUPAC name is 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide.

Molecular Properties

Compound Name2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
PubChem CID175759540
Molecular FormulaC10H9N5OS
Molecular Weight247.28 g/mol
Exact Mass247.05
IUPAC Name2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
SMILESCn1cnc(-c2cn3ncc(C(N)=O)c3s2)c1
InChIInChI=1S/C10H9N5OS/c1-14-3-7(12-5-14)8-4-15-10(17-8)6(2-13-15)9(11)16/h2-5H,1H3,(H2,11,16)
InChIKeyUYRFPRNXIDNYKW-UHFFFAOYSA-N
XLogP0.90
TPSA78.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.28
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
The IUPAC name of 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide (CID 175759540) is 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide.
What is the SMILES notation for 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
The canonical SMILES for 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide is Cn1cnc(-c2cn3ncc(C(N)=O)c3s2)c1.
What is the InChIKey of 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
The InChIKey is UYRFPRNXIDNYKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5OS/c1-14-3-7(12-5-14)8-4-15-10(17-8)6(2-13-15)9(11)16/h2-5H,1H3,(H2,11,16).
What are the key properties of 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide?
2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide has a molecular weight of 247.28 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazol-4-yl)pyrazolo[5,1-b][1,3]thiazole-7-carboxamide is sourced from PubChem (CID 175759540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).