2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

C12H21N5 — CID 118742158

IUPAC2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
SMILESCN1CCN(Cc2cn3c(n2)CNCC3)CC1
InChIInChI=1S/C12H21N5/c1-15-4-6-16(7-5-15)9-11-10-17-3-2-13-8-12(17)14-11/h10,13H,2-9H2,1H3
InChIKeyAAPZAELHBIYZQX-UHFFFAOYSA-N
MW235.33 g/mol
LogP-0.27
Rot. Bonds2

About 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine (PubChem CID 118742158) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
PubChem CID118742158
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
SMILESCN1CCN(Cc2cn3c(n2)CNCC3)CC1
InChIInChI=1S/C12H21N5/c1-15-4-6-16(7-5-15)9-11-10-17-3-2-13-8-12(17)14-11/h10,13H,2-9H2,1H3
InChIKeyAAPZAELHBIYZQX-UHFFFAOYSA-N
XLogP-0.27
TPSA36.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
The IUPAC name of 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine (CID 118742158) is 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
The canonical SMILES for 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine is CN1CCN(Cc2cn3c(n2)CNCC3)CC1.
What is the InChIKey of 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
The InChIKey is AAPZAELHBIYZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-15-4-6-16(7-5-15)9-11-10-17-3-2-13-8-12(17)14-11/h10,13H,2-9H2,1H3.
What are the key properties of 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine?
2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine has a molecular weight of 235.33 g/mol, XLogP of -0.27, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine is sourced from PubChem (CID 118742158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).