6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine

C14H24N4 — CID 80793558

IUPAC6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(N2CCCC(CC)C2)n1
InChIInChI=1S/C14H24N4/c1-3-7-16-13-9-15-10-14(17-13)18-8-5-6-12(4-2)11-18/h9-10,12H,3-8,11H2,1-2H3,(H,16,17)
InChIKeyQSRMDQUYVJRXRO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.92
Rot. Bonds5

About 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine

6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine (PubChem CID 80793558) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine
PubChem CID80793558
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(N2CCCC(CC)C2)n1
InChIInChI=1S/C14H24N4/c1-3-7-16-13-9-15-10-14(17-13)18-8-5-6-12(4-2)11-18/h9-10,12H,3-8,11H2,1-2H3,(H,16,17)
InChIKeyQSRMDQUYVJRXRO-UHFFFAOYSA-N
XLogP2.92
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine?
The IUPAC name of 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine (CID 80793558) is 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine.
What is the SMILES notation for 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine?
The canonical SMILES for 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine is CCCNc1cncc(N2CCCC(CC)C2)n1.
What is the InChIKey of 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine?
The InChIKey is QSRMDQUYVJRXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-3-7-16-13-9-15-10-14(17-13)18-8-5-6-12(4-2)11-18/h9-10,12H,3-8,11H2,1-2H3,(H,16,17).
What are the key properties of 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine?
6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine is sourced from PubChem (CID 80793558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).