2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine

C11H16ClN3O — CID 86321843

IUPAC2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine
SMILESClc1cncc(OCC[C@@H]2CCCCN2)n1
InChIInChI=1S/C11H16ClN3O/c12-10-7-13-8-11(15-10)16-6-4-9-3-1-2-5-14-9/h7-9,14H,1-6H2/t9-/m0/s1
InChIKeyAJFFVQGKZMZNNG-VIFPVBQESA-N
MW241.72 g/mol
LogP2.04
Rot. Bonds4

About 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine

2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine (PubChem CID 86321843) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine.

Molecular Properties

Compound Name2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine
PubChem CID86321843
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine
SMILESClc1cncc(OCC[C@@H]2CCCCN2)n1
InChIInChI=1S/C11H16ClN3O/c12-10-7-13-8-11(15-10)16-6-4-9-3-1-2-5-14-9/h7-9,14H,1-6H2/t9-/m0/s1
InChIKeyAJFFVQGKZMZNNG-VIFPVBQESA-N
XLogP2.04
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-6-(pyrrolidin-2-ylmethoxy)pyrazine
CID 116650736
4-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrimidine
CID 86321830
2-(2-piperidin-2-ylethoxy)quinoxaline
CID 62359871
3,5-dichloro-2-(2-piperidin-2-ylethoxy)pyridine
CID 57061640
4-ethoxy-2-methyl-6-(2-piperidin-2-ylethoxy)pyrimidine
CID 66333125
5-bromo-2-(2-piperidin-2-ylethoxy)pyridine;hydrochloride
CID 71636389
4,6-dimethoxy-2-(2-piperidin-2-ylethoxy)pyrimidine
CID 115355534
6-(2-piperidin-2-ylethoxy)pyridine-2-carboxamide
CID 64589008
3,5-dichloro-2-(2-piperidin-2-ylethoxy)pyridine-4-carboxylic acid
CID 57127962
3-(2-piperidin-2-ylethoxy)pyridine;hydrochloride
CID 56830402
3-(2-piperidin-2-ylethoxy)pyridazine
CID 62483689
6-chloro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973220

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine?
The IUPAC name of 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine (CID 86321843) is 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine.
What is the SMILES notation for 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine?
The canonical SMILES for 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine is Clc1cncc(OCC[C@@H]2CCCCN2)n1.
What is the InChIKey of 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine?
The InChIKey is AJFFVQGKZMZNNG-VIFPVBQESA-N. The full InChI is InChI=1S/C11H16ClN3O/c12-10-7-13-8-11(15-10)16-6-4-9-3-1-2-5-14-9/h7-9,14H,1-6H2/t9-/m0/s1.
What are the key properties of 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine?
2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine has a molecular weight of 241.72 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[2-[(2S)-piperidin-2-yl]ethoxy]pyrazine is sourced from PubChem (CID 86321843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).