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

C17H18N10 — CID 71158120

IUPACN-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1cn2c(-c3cn[nH]c3)cnc(Nc3cnc(N4CCNCC4)nc3)c2n1
InChIInChI=1S/C17H18N10/c1-4-26(5-2-18-1)17-21-9-13(10-22-17)25-15-16-19-3-6-27(16)14(11-20-15)12-7-23-24-8-12/h3,6-11,18H,1-2,4-5H2,(H,20,25)(H,23,24)
InChIKeyPKFQHAFGLNGTDG-UHFFFAOYSA-N
MW362.40 g/mol
LogP1.06
Rot. Bonds4

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

N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 71158120) has the molecular formula C17H18N10 and a molecular weight of 362.40 g/mol. Its IUPAC name is N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID71158120
Molecular FormulaC17H18N10
Molecular Weight362.40 g/mol
Exact Mass362.17
IUPAC NameN-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1cn2c(-c3cn[nH]c3)cnc(Nc3cnc(N4CCNCC4)nc3)c2n1
InChIInChI=1S/C17H18N10/c1-4-26(5-2-18-1)17-21-9-13(10-22-17)25-15-16-19-3-6-27(16)14(11-20-15)12-7-23-24-8-12/h3,6-11,18H,1-2,4-5H2,(H,20,25)(H,23,24)
InChIKeyPKFQHAFGLNGTDG-UHFFFAOYSA-N
XLogP1.06
TPSA111.95 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine (CID 71158120) is N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine is c1cn2c(-c3cn[nH]c3)cnc(Nc3cnc(N4CCNCC4)nc3)c2n1.
What is the InChIKey of N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is PKFQHAFGLNGTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N10/c1-4-26(5-2-18-1)17-21-9-13(10-22-17)25-15-16-19-3-6-27(16)14(11-20-15)12-7-23-24-8-12/h3,6-11,18H,1-2,4-5H2,(H,20,25)(H,23,24).
What are the key properties of N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine?
N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 362.40 g/mol, XLogP of 1.06, 4 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylpyrimidin-5-yl)-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 71158120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).