6-benzyl-5H-imidazo[1,2-b]pyrazole

C12H11N3 — CID 3076270

IUPAC6-benzyl-5H-imidazo[1,2-b]pyrazole
SMILESc1ccc(Cc2cc3nccn3[nH]2)cc1
InChIInChI=1S/C12H11N3/c1-2-4-10(5-3-1)8-11-9-12-13-6-7-15(12)14-11/h1-7,9,14H,8H2
InChIKeyRZPAPAFMVGDYFE-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.25
Rot. Bonds2

About 6-benzyl-5H-imidazo[1,2-b]pyrazole

6-benzyl-5H-imidazo[1,2-b]pyrazole (PubChem CID 3076270) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 6-benzyl-5H-imidazo[1,2-b]pyrazole.

Molecular Properties

Compound Name6-benzyl-5H-imidazo[1,2-b]pyrazole
PubChem CID3076270
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name6-benzyl-5H-imidazo[1,2-b]pyrazole
SMILESc1ccc(Cc2cc3nccn3[nH]2)cc1
InChIInChI=1S/C12H11N3/c1-2-4-10(5-3-1)8-11-9-12-13-6-7-15(12)14-11/h1-7,9,14H,8H2
InChIKeyRZPAPAFMVGDYFE-UHFFFAOYSA-N
XLogP2.25
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-benzyl-5H-imidazo[1,2-b]pyrazole?
The IUPAC name of 6-benzyl-5H-imidazo[1,2-b]pyrazole (CID 3076270) is 6-benzyl-5H-imidazo[1,2-b]pyrazole.
What is the SMILES notation for 6-benzyl-5H-imidazo[1,2-b]pyrazole?
The canonical SMILES for 6-benzyl-5H-imidazo[1,2-b]pyrazole is c1ccc(Cc2cc3nccn3[nH]2)cc1.
What is the InChIKey of 6-benzyl-5H-imidazo[1,2-b]pyrazole?
The InChIKey is RZPAPAFMVGDYFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-2-4-10(5-3-1)8-11-9-12-13-6-7-15(12)14-11/h1-7,9,14H,8H2.
What are the key properties of 6-benzyl-5H-imidazo[1,2-b]pyrazole?
6-benzyl-5H-imidazo[1,2-b]pyrazole has a molecular weight of 197.24 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-5H-imidazo[1,2-b]pyrazole is sourced from PubChem (CID 3076270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).