N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine

C15H11ClN6 — CID 6419830

IUPACN-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESClc1ccc(Nc2ncc(-c3cn[nH]c3)n3ccnc23)cc1
InChIInChI=1S/C15H11ClN6/c16-11-1-3-12(4-2-11)21-14-15-17-5-6-22(15)13(9-18-14)10-7-19-20-8-10/h1-9H,(H,18,21)(H,19,20)
InChIKeyIBTKWZIRFYKTGV-UHFFFAOYSA-N
MW310.75 g/mol
LogP3.52
Rot. Bonds3

About N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine

N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 6419830) has the molecular formula C15H11ClN6 and a molecular weight of 310.75 g/mol. Its IUPAC name is N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID6419830
Molecular FormulaC15H11ClN6
Molecular Weight310.75 g/mol
Exact Mass310.07
IUPAC NameN-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESClc1ccc(Nc2ncc(-c3cn[nH]c3)n3ccnc23)cc1
InChIInChI=1S/C15H11ClN6/c16-11-1-3-12(4-2-11)21-14-15-17-5-6-22(15)13(9-18-14)10-7-19-20-8-10/h1-9H,(H,18,21)(H,19,20)
InChIKeyIBTKWZIRFYKTGV-UHFFFAOYSA-N
XLogP3.52
TPSA70.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.75
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine (CID 6419830) is N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine is Clc1ccc(Nc2ncc(-c3cn[nH]c3)n3ccnc23)cc1.
What is the InChIKey of N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is IBTKWZIRFYKTGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN6/c16-11-1-3-12(4-2-11)21-14-15-17-5-6-22(15)13(9-18-14)10-7-19-20-8-10/h1-9H,(H,18,21)(H,19,20).
What are the key properties of N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 310.75 g/mol, XLogP of 3.52, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 6419830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).