2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile

C18H11FN4 — CID 11185723

IUPAC2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile
SMILESN#Cc1c(-c2ccccc2)[nH]n2cc(-c3ccc(F)cc3)nc12
InChIInChI=1S/C18H11FN4/c19-14-8-6-12(7-9-14)16-11-23-18(21-16)15(10-20)17(22-23)13-4-2-1-3-5-13/h1-9,11,22H
InChIKeyLAIRPLVZDWDWIG-UHFFFAOYSA-N
MW302.31 g/mol
LogP4.01
Rot. Bonds2

About 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile

2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile (PubChem CID 11185723) has the molecular formula C18H11FN4 and a molecular weight of 302.31 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile
PubChem CID11185723
Molecular FormulaC18H11FN4
Molecular Weight302.31 g/mol
Exact Mass302.10
IUPAC Name2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile
SMILESN#Cc1c(-c2ccccc2)[nH]n2cc(-c3ccc(F)cc3)nc12
InChIInChI=1S/C18H11FN4/c19-14-8-6-12(7-9-14)16-11-23-18(21-16)15(10-20)17(22-23)13-4-2-1-3-5-13/h1-9,11,22H
InChIKeyLAIRPLVZDWDWIG-UHFFFAOYSA-N
XLogP4.01
TPSA56.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile?
The IUPAC name of 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile (CID 11185723) is 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile.
What is the SMILES notation for 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile?
The canonical SMILES for 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile is N#Cc1c(-c2ccccc2)[nH]n2cc(-c3ccc(F)cc3)nc12.
What is the InChIKey of 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile?
The InChIKey is LAIRPLVZDWDWIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11FN4/c19-14-8-6-12(7-9-14)16-11-23-18(21-16)15(10-20)17(22-23)13-4-2-1-3-5-13/h1-9,11,22H.
What are the key properties of 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile?
2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile has a molecular weight of 302.31 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-phenyl-5H-imidazo[1,2-b]pyrazole-7-carbonitrile is sourced from PubChem (CID 11185723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).