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

C6H8ClN3 — CID 75360911

IUPAC1-(5-chloropyrazin-2-yl)ethanamine
SMILESCC(N)c1cnc(Cl)cn1
InChIInChI=1S/C6H8ClN3/c1-4(8)5-2-10-6(7)3-9-5/h2-4H,8H2,1H3
InChIKeySXBSRDJNLZZIFB-UHFFFAOYSA-N
MW157.60 g/mol
LogP1.15
Rot. Bonds1

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

1-(5-chloropyrazin-2-yl)ethanamine (PubChem CID 75360911) has the molecular formula C6H8ClN3 and a molecular weight of 157.60 g/mol. Its IUPAC name is 1-(5-chloropyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(5-chloropyrazin-2-yl)ethanamine
PubChem CID75360911
Molecular FormulaC6H8ClN3
Molecular Weight157.60 g/mol
Exact Mass157.04
IUPAC Name1-(5-chloropyrazin-2-yl)ethanamine
SMILESCC(N)c1cnc(Cl)cn1
InChIInChI=1S/C6H8ClN3/c1-4(8)5-2-10-6(7)3-9-5/h2-4H,8H2,1H3
InChIKeySXBSRDJNLZZIFB-UHFFFAOYSA-N
XLogP1.15
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.60
LogP ≤ 51.15
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?
The IUPAC name of 1-(5-chloropyrazin-2-yl)ethanamine (CID 75360911) is 1-(5-chloropyrazin-2-yl)ethanamine.
What is the SMILES notation for 1-(5-chloropyrazin-2-yl)ethanamine?
The canonical SMILES for 1-(5-chloropyrazin-2-yl)ethanamine is CC(N)c1cnc(Cl)cn1.
What is the InChIKey of 1-(5-chloropyrazin-2-yl)ethanamine?
The InChIKey is SXBSRDJNLZZIFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3/c1-4(8)5-2-10-6(7)3-9-5/h2-4H,8H2,1H3.
What are the key properties of 1-(5-chloropyrazin-2-yl)ethanamine?
1-(5-chloropyrazin-2-yl)ethanamine has a molecular weight of 157.60 g/mol, XLogP of 1.15, 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 is sourced from PubChem (CID 75360911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).