2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine

Name: 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₂H₁₈ClN₃ — CID 103054128

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine

SMILESCCC1CCN(Cc2cnc(Cl)cn2)CC1

InChIInChI=1S/C12H18ClN3/c1-2-10-3-5-16(6-4-10)9-11-7-15-12(13)8-14-11/h7-8,10H,2-6,9H2,1H3

InChIKeyUWUOUNKWQGEANV-UHFFFAOYSA-N

MW239.75 g/mol

LogP2.75

Rot. Bonds3

About 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine

2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine (PubChem CID 103054128) has the molecular formula C₁₂H₁₈ClN₃ and a molecular weight of 239.75 g/mol. Its IUPAC name is 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine.

Molecular Properties

Compound Name	2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine
PubChem CID	103054128
Molecular Formula	C₁₂H₁₈ClN₃
Molecular Weight	239.75 g/mol
Exact Mass	239.12
IUPAC Name	2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine
SMILES	CCC1CCN(Cc2cnc(Cl)cn2)CC1
InChI	InChI=1S/C12H18ClN3/c1-2-10-3-5-16(6-4-10)9-11-7-15-12(13)8-14-11/h7-8,10H,2-6,9H2,1H3
InChIKey	UWUOUNKWQGEANV-UHFFFAOYSA-N
XLogP	2.75
TPSA	29.02 Å²
H-Bond Donors
H-Bond Acceptors	3
Rotatable Bonds	3
Heavy Atoms	16
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	239.75
LogP ≤ 5	2.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine?

The IUPAC name of 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine (CID 103054128) is 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine.

What is the SMILES notation for 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine?

The canonical SMILES for 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine is CCC1CCN(Cc2cnc(Cl)cn2)CC1.

What is the InChIKey of 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine?

The InChIKey is UWUOUNKWQGEANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3/c1-2-10-3-5-16(6-4-10)9-11-7-15-12(13)8-14-11/h7-8,10H,2-6,9H2,1H3.

What are the key properties of 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine?

2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine has a molecular weight of 239.75 g/mol, XLogP of 2.75, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-5-[(4-ethylpiperidin-1-yl)methyl]pyrazine is sourced from PubChem (CID 103054128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 103054128 — identifiers, structure, computed properties (public domain)

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