2-methyl-3-piperazin-1-ylpyrazine

C9H14N4 — CID 45099710

IUPAC2-methyl-3-piperazin-1-ylpyrazine
SMILESCc1nccnc1N1CCNCC1
InChIInChI=1S/C9H14N4/c1-8-9(12-3-2-11-8)13-6-4-10-5-7-13/h2-3,10H,4-7H2,1H3
InChIKeyUIYIEUWPSAMPNA-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.19
Rot. Bonds1

About 2-methyl-3-piperazin-1-ylpyrazine

2-methyl-3-piperazin-1-ylpyrazine (PubChem CID 45099710) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-methyl-3-piperazin-1-ylpyrazine.

Molecular Properties

Compound Name2-methyl-3-piperazin-1-ylpyrazine
PubChem CID45099710
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name2-methyl-3-piperazin-1-ylpyrazine
SMILESCc1nccnc1N1CCNCC1
InChIInChI=1S/C9H14N4/c1-8-9(12-3-2-11-8)13-6-4-10-5-7-13/h2-3,10H,4-7H2,1H3
InChIKeyUIYIEUWPSAMPNA-UHFFFAOYSA-N
XLogP0.19
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Modaline
CID 17860
6-(Cyclohexylamino)pyrazine-2-carbonitrile
CID 16108898
2-Amino-3-methylpyrazine
CID 302284
Pyrazine, 2-methyl-3-piperidino-, monohydrochloride
CID 83550
3-(Methylamino)pyrazine-2-carbonitrile
CID 821140
N,N-diethyl-2-[4-(5-methylpyrazin-2-yl)piperazin-1-yl]ethanamine
CID 49778905
2-Methyl-6-piperazin-1-ylpyrazine;hydrochloride
CID 90674676
5,6-Dimethylpyrazin-2-amine
CID 222763
N,3-Dimethylpyrazin-2-amine
CID 44327445
N,N,3-Trimethylpyrazin-2-amine
CID 44327689
3-(Diethylamino)pyrazine-2,5-dicarbonitrile
CID 57391054
N,N,3,6-tetramethylpyrazin-2-amine
CID 8009163

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-piperazin-1-ylpyrazine?
The IUPAC name of 2-methyl-3-piperazin-1-ylpyrazine (CID 45099710) is 2-methyl-3-piperazin-1-ylpyrazine.
What is the SMILES notation for 2-methyl-3-piperazin-1-ylpyrazine?
The canonical SMILES for 2-methyl-3-piperazin-1-ylpyrazine is Cc1nccnc1N1CCNCC1.
What is the InChIKey of 2-methyl-3-piperazin-1-ylpyrazine?
The InChIKey is UIYIEUWPSAMPNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-8-9(12-3-2-11-8)13-6-4-10-5-7-13/h2-3,10H,4-7H2,1H3.
What are the key properties of 2-methyl-3-piperazin-1-ylpyrazine?
2-methyl-3-piperazin-1-ylpyrazine has a molecular weight of 178.24 g/mol, XLogP of 0.19, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-piperazin-1-ylpyrazine is sourced from PubChem (CID 45099710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).