1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone

C11H16N4O — CID 58347537

IUPAC1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone
SMILESNC1CCN(C(=O)Cc2cnccn2)CC1
InChIInChI=1S/C11H16N4O/c12-9-1-5-15(6-2-9)11(16)7-10-8-13-3-4-14-10/h3-4,8-9H,1-2,5-7,12H2
InChIKeyQOWMIHAIOFGPCG-UHFFFAOYSA-N
MW220.28 g/mol
LogP-0.03
Rot. Bonds2

About 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone

1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone (PubChem CID 58347537) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone.

Molecular Properties

Compound Name1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone
PubChem CID58347537
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone
SMILESNC1CCN(C(=O)Cc2cnccn2)CC1
InChIInChI=1S/C11H16N4O/c12-9-1-5-15(6-2-9)11(16)7-10-8-13-3-4-14-10/h3-4,8-9H,1-2,5-7,12H2
InChIKeyQOWMIHAIOFGPCG-UHFFFAOYSA-N
XLogP-0.03
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone?
The IUPAC name of 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone (CID 58347537) is 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone.
What is the SMILES notation for 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone?
The canonical SMILES for 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone is NC1CCN(C(=O)Cc2cnccn2)CC1.
What is the InChIKey of 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone?
The InChIKey is QOWMIHAIOFGPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c12-9-1-5-15(6-2-9)11(16)7-10-8-13-3-4-14-10/h3-4,8-9H,1-2,5-7,12H2.
What are the key properties of 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone?
1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone has a molecular weight of 220.28 g/mol, XLogP of -0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminopiperidin-1-yl)-2-pyrazin-2-ylethanone is sourced from PubChem (CID 58347537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).