2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride

C10H16ClN3O — CID 71636992

IUPAC2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride
SMILESCl.c1cnc(COC2CCNCC2)cn1
InChIInChI=1S/C10H15N3O.ClH/c1-3-11-4-2-10(1)14-8-9-7-12-5-6-13-9;/h5-7,10-11H,1-4,8H2;1H
InChIKeyDGDZEUAIBSSWRO-UHFFFAOYSA-N
MW229.71 g/mol
LogP1.17
Rot. Bonds3

About 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride

2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride (PubChem CID 71636992) has the molecular formula C10H16ClN3O and a molecular weight of 229.71 g/mol. Its IUPAC name is 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride.

Molecular Properties

Compound Name2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride
PubChem CID71636992
Molecular FormulaC10H16ClN3O
Molecular Weight229.71 g/mol
Exact Mass229.10
IUPAC Name2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride
SMILESCl.c1cnc(COC2CCNCC2)cn1
InChIInChI=1S/C10H15N3O.ClH/c1-3-11-4-2-10(1)14-8-9-7-12-5-6-13-9;/h5-7,10-11H,1-4,8H2;1H
InChIKeyDGDZEUAIBSSWRO-UHFFFAOYSA-N
XLogP1.17
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride?
The IUPAC name of 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride (CID 71636992) is 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride.
What is the SMILES notation for 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride?
The canonical SMILES for 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride is Cl.c1cnc(COC2CCNCC2)cn1.
What is the InChIKey of 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride?
The InChIKey is DGDZEUAIBSSWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O.ClH/c1-3-11-4-2-10(1)14-8-9-7-12-5-6-13-9;/h5-7,10-11H,1-4,8H2;1H.
What are the key properties of 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride?
2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride has a molecular weight of 229.71 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidin-4-yloxymethyl)pyrazine;hydrochloride is sourced from PubChem (CID 71636992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).