N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine

C17H16N6O — CID 52945317

IUPACN-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(Nc2nc(-c3ccn(C)n3)cn3ccnc23)cc1
InChIInChI=1S/C17H16N6O/c1-22-9-7-14(21-22)15-11-23-10-8-18-17(23)16(20-15)19-12-3-5-13(24-2)6-4-12/h3-11H,1-2H3,(H,19,20)
InChIKeyQSLPGSHFQOUVJX-UHFFFAOYSA-N
MW320.36 g/mol
LogP2.88
Rot. Bonds4

About N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine

N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 52945317) has the molecular formula C17H16N6O and a molecular weight of 320.36 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID52945317
Molecular FormulaC17H16N6O
Molecular Weight320.36 g/mol
Exact Mass320.14
IUPAC NameN-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(Nc2nc(-c3ccn(C)n3)cn3ccnc23)cc1
InChIInChI=1S/C17H16N6O/c1-22-9-7-14(21-22)15-11-23-10-8-18-17(23)16(20-15)19-12-3-5-13(24-2)6-4-12/h3-11H,1-2H3,(H,19,20)
InChIKeyQSLPGSHFQOUVJX-UHFFFAOYSA-N
XLogP2.88
TPSA69.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.36
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine (CID 52945317) is N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine is COc1ccc(Nc2nc(-c3ccn(C)n3)cn3ccnc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is QSLPGSHFQOUVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O/c1-22-9-7-14(21-22)15-11-23-10-8-18-17(23)16(20-15)19-12-3-5-13(24-2)6-4-12/h3-11H,1-2H3,(H,19,20).
What are the key properties of N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine?
N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 320.36 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-6-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 52945317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).