2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine

C15H27N5 — CID 114474787

IUPAC2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine
SMILESCCCC(CN)N1CCN(c2cnc(C)c(C)n2)CC1
InChIInChI=1S/C15H27N5/c1-4-5-14(10-16)19-6-8-20(9-7-19)15-11-17-12(2)13(3)18-15/h11,14H,4-10,16H2,1-3H3
InChIKeyBUDLBUKWHJKLRT-UHFFFAOYSA-N
MW277.42 g/mol
LogP1.34
Rot. Bonds5

About 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine

2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine (PubChem CID 114474787) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine.

Molecular Properties

Compound Name2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine
PubChem CID114474787
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine
SMILESCCCC(CN)N1CCN(c2cnc(C)c(C)n2)CC1
InChIInChI=1S/C15H27N5/c1-4-5-14(10-16)19-6-8-20(9-7-19)15-11-17-12(2)13(3)18-15/h11,14H,4-10,16H2,1-3H3
InChIKeyBUDLBUKWHJKLRT-UHFFFAOYSA-N
XLogP1.34
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine?
The IUPAC name of 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine (CID 114474787) is 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine.
What is the SMILES notation for 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine?
The canonical SMILES for 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine is CCCC(CN)N1CCN(c2cnc(C)c(C)n2)CC1.
What is the InChIKey of 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine?
The InChIKey is BUDLBUKWHJKLRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-4-5-14(10-16)19-6-8-20(9-7-19)15-11-17-12(2)13(3)18-15/h11,14H,4-10,16H2,1-3H3.
What are the key properties of 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine?
2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine has a molecular weight of 277.42 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5,6-dimethylpyrazin-2-yl)piperazin-1-yl]pentan-1-amine is sourced from PubChem (CID 114474787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).