6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole

C15H17N3O — CID 20719488

IUPAC6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole
SMILESCCOc1[nH]n2c(C)c(-c3ccccc3)nc2c1C
InChIInChI=1S/C15H17N3O/c1-4-19-15-10(2)14-16-13(11(3)18(14)17-15)12-8-6-5-7-9-12/h5-9,17H,4H2,1-3H3
InChIKeyCVZGKLGBVHARSP-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.34
Rot. Bonds3

About 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole

6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole (PubChem CID 20719488) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole.

Molecular Properties

Compound Name6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole
PubChem CID20719488
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole
SMILESCCOc1[nH]n2c(C)c(-c3ccccc3)nc2c1C
InChIInChI=1S/C15H17N3O/c1-4-19-15-10(2)14-16-13(11(3)18(14)17-15)12-8-6-5-7-9-12/h5-9,17H,4H2,1-3H3
InChIKeyCVZGKLGBVHARSP-UHFFFAOYSA-N
XLogP3.34
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole?
The IUPAC name of 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole (CID 20719488) is 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole.
What is the SMILES notation for 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole?
The canonical SMILES for 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole is CCOc1[nH]n2c(C)c(-c3ccccc3)nc2c1C.
What is the InChIKey of 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole?
The InChIKey is CVZGKLGBVHARSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-4-19-15-10(2)14-16-13(11(3)18(14)17-15)12-8-6-5-7-9-12/h5-9,17H,4H2,1-3H3.
What are the key properties of 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole?
6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole has a molecular weight of 255.32 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-3,7-dimethyl-2-phenyl-5H-imidazo[1,2-b]pyrazole is sourced from PubChem (CID 20719488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).