2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine

C12H11Cl2N3 — CID 65321517

IUPAC2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1cnccn1
InChIInChI=1S/C12H11Cl2N3/c13-9-1-2-10(14)8(5-9)6-11(15)12-7-16-3-4-17-12/h1-5,7,11H,6,15H2
InChIKeyIGFJCIJNUFMABG-UHFFFAOYSA-N
MW268.15 g/mol
LogP3.03
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine

2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine (PubChem CID 65321517) has the molecular formula C12H11Cl2N3 and a molecular weight of 268.15 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine
PubChem CID65321517
Molecular FormulaC12H11Cl2N3
Molecular Weight268.15 g/mol
Exact Mass267.03
IUPAC Name2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1cnccn1
InChIInChI=1S/C12H11Cl2N3/c13-9-1-2-10(14)8(5-9)6-11(15)12-7-16-3-4-17-12/h1-5,7,11H,6,15H2
InChIKeyIGFJCIJNUFMABG-UHFFFAOYSA-N
XLogP3.03
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.15
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenyl)-1-pyrazin-2-ylethanamine
CID 60819170
2-(3-chlorophenyl)-1-pyrazin-2-ylethanamine
CID 60818285
2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine
CID 65321274
2-(2,5-dichlorophenyl)-1-(3-methoxy-4-pyridinyl)ethanamine
CID 105065635
2-(2,5-dichlorophenyl)-1-(1-methyltriazol-4-yl)ethanamine
CID 112735844
1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethanamine
CID 114885921
2-(2,5-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethanamine
CID 65321175
2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine
CID 105151425
1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)ethanamine
CID 106692129
1,4-dichloro-2-(3-chloro-2-methylpropyl)benzene
CID 64664629
2-(2,5-dichlorophenyl)-1-thiophen-2-ylethanamine
CID 65321861
(2,4-dichlorophenyl)-pyrazin-2-ylmethanol
CID 63970677

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine (CID 65321517) is 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine is NC(Cc1cc(Cl)ccc1Cl)c1cnccn1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine?
The InChIKey is IGFJCIJNUFMABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3/c13-9-1-2-10(14)8(5-9)6-11(15)12-7-16-3-4-17-12/h1-5,7,11H,6,15H2.
What are the key properties of 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine?
2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine has a molecular weight of 268.15 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine is sourced from PubChem (CID 65321517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).