2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine

C12H22N6 — CID 83028182

IUPAC2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NN2CCN(C)CC2)n1
InChIInChI=1S/C12H22N6/c1-3-4-14-11-9-13-10-12(15-11)16-18-7-5-17(2)6-8-18/h9-10H,3-8H2,1-2H3,(H2,14,15,16)
InChIKeyZLPXUYGTWBAIHV-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.87
Rot. Bonds5

About 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine

2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine (PubChem CID 83028182) has the molecular formula C12H22N6 and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine
PubChem CID83028182
Molecular FormulaC12H22N6
Molecular Weight250.35 g/mol
Exact Mass250.19
IUPAC Name2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NN2CCN(C)CC2)n1
InChIInChI=1S/C12H22N6/c1-3-4-14-11-9-13-10-12(15-11)16-18-7-5-17(2)6-8-18/h9-10H,3-8H2,1-2H3,(H2,14,15,16)
InChIKeyZLPXUYGTWBAIHV-UHFFFAOYSA-N
XLogP0.87
TPSA56.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-piperidin-1-yl-6-N-propylpyrazine-2,6-diamine
CID 83027760
2-methyl-4-N-(4-methylpiperazin-1-yl)-6-N-propylpyrimidine-4,6-diamine
CID 83027220
2-N-[(1-methylpyrrolidin-3-yl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80791122
2-N-methyl-2-N-[(1-methylpiperidin-4-yl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80827748
2-N-(4-methylpiperazin-1-yl)-3-nitro-6-N-propylpyridine-2,6-diamine
CID 83034182
N-propyl-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrazin-2-amine
CID 80823221
2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)-6-N-propylpyrimidine-4,6-diamine
CID 83027383
6-chloro-N-propylpyrazin-2-amine
CID 26370207
6-N-propyl-2-N-(2,2,2-trifluoroethyl)pyrazine-2,6-diamine
CID 80785273
2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine
CID 80769930
6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine
CID 78990309
2-N-(2-cyclobutylethyl)-6-N-propylpyrazine-2,6-diamine
CID 113479503

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine?
The IUPAC name of 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine (CID 83028182) is 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine is CCCNc1cncc(NN2CCN(C)CC2)n1.
What is the InChIKey of 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine?
The InChIKey is ZLPXUYGTWBAIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6/c1-3-4-14-11-9-13-10-12(15-11)16-18-7-5-17(2)6-8-18/h9-10H,3-8H2,1-2H3,(H2,14,15,16).
What are the key properties of 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine?
2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine has a molecular weight of 250.35 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-methylpiperazin-1-yl)-6-N-propylpyrazine-2,6-diamine is sourced from PubChem (CID 83028182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).