1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone

C11H15N3O — CID 63845687

IUPAC1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone
SMILESCC(=O)C1CCCCN1c1cnccn1
InChIInChI=1S/C11H15N3O/c1-9(15)10-4-2-3-7-14(10)11-8-12-5-6-13-11/h5-6,8,10H,2-4,7H2,1H3
InChIKeyCLRIRXVEUPWKFR-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.42
Rot. Bonds2

About 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone

1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone (PubChem CID 63845687) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone.

Molecular Properties

Compound Name1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone
PubChem CID63845687
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone
SMILESCC(=O)C1CCCCN1c1cnccn1
InChIInChI=1S/C11H15N3O/c1-9(15)10-4-2-3-7-14(10)11-8-12-5-6-13-11/h5-6,8,10H,2-4,7H2,1H3
InChIKeyCLRIRXVEUPWKFR-UHFFFAOYSA-N
XLogP1.42
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone?
The IUPAC name of 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone (CID 63845687) is 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone.
What is the SMILES notation for 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone?
The canonical SMILES for 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone is CC(=O)C1CCCCN1c1cnccn1.
What is the InChIKey of 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone?
The InChIKey is CLRIRXVEUPWKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-9(15)10-4-2-3-7-14(10)11-8-12-5-6-13-11/h5-6,8,10H,2-4,7H2,1H3.
What are the key properties of 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone?
1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone has a molecular weight of 205.26 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyrazin-2-ylpiperidin-2-yl)ethanone is sourced from PubChem (CID 63845687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).