2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol

C11H16ClN3O2 — CID 133315157

IUPAC2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol
SMILESOCCOC1CCCN(c2cncc(Cl)n2)C1
InChIInChI=1S/C11H16ClN3O2/c12-10-6-13-7-11(14-10)15-3-1-2-9(8-15)17-5-4-16/h6-7,9,16H,1-5,8H2
InChIKeyMFQPSCHQNKXXLL-UHFFFAOYSA-N
MW257.72 g/mol
LogP1.11
Rot. Bonds4

About 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol

2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol (PubChem CID 133315157) has the molecular formula C11H16ClN3O2 and a molecular weight of 257.72 g/mol. Its IUPAC name is 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol
PubChem CID133315157
Molecular FormulaC11H16ClN3O2
Molecular Weight257.72 g/mol
Exact Mass257.09
IUPAC Name2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol
SMILESOCCOC1CCCN(c2cncc(Cl)n2)C1
InChIInChI=1S/C11H16ClN3O2/c12-10-6-13-7-11(14-10)15-3-1-2-9(8-15)17-5-4-16/h6-7,9,16H,1-5,8H2
InChIKeyMFQPSCHQNKXXLL-UHFFFAOYSA-N
XLogP1.11
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-propoxypiperidin-1-yl)pyrazine-2-carboxylic acid
CID 66450862
2-chloro-6-(3-methylpiperidin-1-yl)pyrazine
CID 53409115
N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine
CID 66451853
[6-[3-(2-hydroxyethoxy)piperidin-1-yl]-3-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 133315243
2-(1-pyrimidin-2-ylpiperidin-3-yl)oxyethanol
CID 133315289
1-(6-chloropyrazin-2-yl)azepan-4-ol
CID 130702579
methyl 6-(3-ethoxypiperidin-1-yl)pyrazine-2-carboxylate
CID 66451057
(3R)-1-(6-chloropyrazin-2-yl)pyrrolidin-3-ol
CID 86323671
N-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]propanamide
CID 71996611
3-chloro-6-(3-propoxypiperidin-1-yl)pyridazine
CID 54989826
2-chloro-6-(3-propoxypiperidin-1-yl)pyridine-4-carbonitrile
CID 83073559
2-[1-(6-chloropyrazin-2-yl)piperidin-4-yl]oxyacetic acid
CID 114335425

Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol?
The IUPAC name of 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol (CID 133315157) is 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol.
What is the SMILES notation for 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol?
The canonical SMILES for 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol is OCCOC1CCCN(c2cncc(Cl)n2)C1.
What is the InChIKey of 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol?
The InChIKey is MFQPSCHQNKXXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O2/c12-10-6-13-7-11(14-10)15-3-1-2-9(8-15)17-5-4-16/h6-7,9,16H,1-5,8H2.
What are the key properties of 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol?
2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol has a molecular weight of 257.72 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]oxyethanol is sourced from PubChem (CID 133315157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).