2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine

C12H18N4 — CID 133468968

IUPAC2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine
SMILESCc1cncc(N2CCN(C3CC3)CC2)n1
InChIInChI=1S/C12H18N4/c1-10-8-13-9-12(14-10)16-6-4-15(5-7-16)11-2-3-11/h8-9,11H,2-7H2,1H3
InChIKeyJYEAWHAHSSWUDD-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.07
Rot. Bonds2

About 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine

2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine (PubChem CID 133468968) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine.

Molecular Properties

Compound Name2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine
PubChem CID133468968
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine
SMILESCc1cncc(N2CCN(C3CC3)CC2)n1
InChIInChI=1S/C12H18N4/c1-10-8-13-9-12(14-10)16-6-4-15(5-7-16)11-2-3-11/h8-9,11H,2-7H2,1H3
InChIKeyJYEAWHAHSSWUDD-UHFFFAOYSA-N
XLogP1.07
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine?
The IUPAC name of 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine (CID 133468968) is 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine.
What is the SMILES notation for 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine?
The canonical SMILES for 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine is Cc1cncc(N2CCN(C3CC3)CC2)n1.
What is the InChIKey of 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine?
The InChIKey is JYEAWHAHSSWUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-10-8-13-9-12(14-10)16-6-4-15(5-7-16)11-2-3-11/h8-9,11H,2-7H2,1H3.
What are the key properties of 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine?
2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine has a molecular weight of 218.30 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine is sourced from PubChem (CID 133468968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).