1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride

C6H9Cl2N3 — CID 146082236

IUPAC1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride
SMILESCC(N)c1cnc(Cl)cn1.Cl
InChIInChI=1S/C6H8ClN3.ClH/c1-4(8)5-2-10-6(7)3-9-5;/h2-4H,8H2,1H3;1H
InChIKeyFYIYTXHJXYEOAT-UHFFFAOYSA-N
MW194.07 g/mol
LogP1.57
Rot. Bonds1

About 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride

1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride (PubChem CID 146082236) has the molecular formula C6H9Cl2N3 and a molecular weight of 194.07 g/mol. Its IUPAC name is 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride
PubChem CID146082236
Molecular FormulaC6H9Cl2N3
Molecular Weight194.07 g/mol
Exact Mass193.02
IUPAC Name1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride
SMILESCC(N)c1cnc(Cl)cn1.Cl
InChIInChI=1S/C6H8ClN3.ClH/c1-4(8)5-2-10-6(7)3-9-5;/h2-4H,8H2,1H3;1H
InChIKeyFYIYTXHJXYEOAT-UHFFFAOYSA-N
XLogP1.57
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.07
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride?
The IUPAC name of 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride (CID 146082236) is 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride is CC(N)c1cnc(Cl)cn1.Cl.
What is the InChIKey of 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride?
The InChIKey is FYIYTXHJXYEOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3.ClH/c1-4(8)5-2-10-6(7)3-9-5;/h2-4H,8H2,1H3;1H.
What are the key properties of 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride?
1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride has a molecular weight of 194.07 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloropyrazin-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 146082236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).