2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine

C13H16N4 — CID 68786229

IUPAC2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine
SMILESCc1ccc(-c2nc3n(c2N)CCNC3)cc1
InChIInChI=1S/C13H16N4/c1-9-2-4-10(5-3-9)12-13(14)17-7-6-15-8-11(17)16-12/h2-5,15H,6-8,14H2,1H3
InChIKeyBZIMLSOYZLNCHT-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.54
Rot. Bonds1

About 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine

2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine (PubChem CID 68786229) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine
PubChem CID68786229
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine
SMILESCc1ccc(-c2nc3n(c2N)CCNC3)cc1
InChIInChI=1S/C13H16N4/c1-9-2-4-10(5-3-9)12-13(14)17-7-6-15-8-11(17)16-12/h2-5,15H,6-8,14H2,1H3
InChIKeyBZIMLSOYZLNCHT-UHFFFAOYSA-N
XLogP1.54
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine (CID 68786229) is 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine is Cc1ccc(-c2nc3n(c2N)CCNC3)cc1.
What is the InChIKey of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
The InChIKey is BZIMLSOYZLNCHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-9-2-4-10(5-3-9)12-13(14)17-7-6-15-8-11(17)16-12/h2-5,15H,6-8,14H2,1H3.
What are the key properties of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine?
2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine has a molecular weight of 228.30 g/mol, XLogP of 1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 68786229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).