5-chloropyrazin-2-amine

C4H4ClN3 — CID 12808419

IUPAC5-chloropyrazin-2-amine
SMILESNc1cnc(Cl)cn1
InChIInChI=1S/C4H4ClN3/c5-3-1-8-4(6)2-7-3/h1-2H,(H2,6,8)
InChIKeyHWCKAMAVEWVBDO-UHFFFAOYSA-N
MW129.55 g/mol
LogP0.71
Rot. Bonds

About 5-chloropyrazin-2-amine

5-chloropyrazin-2-amine (PubChem CID 12808419) has the molecular formula C4H4ClN3 and a molecular weight of 129.55 g/mol. Its IUPAC name is 5-chloropyrazin-2-amine.

Molecular Properties

Compound Name5-chloropyrazin-2-amine
PubChem CID12808419
Molecular FormulaC4H4ClN3
Molecular Weight129.55 g/mol
Exact Mass129.01
IUPAC Name5-chloropyrazin-2-amine
SMILESNc1cnc(Cl)cn1
InChIInChI=1S/C4H4ClN3/c5-3-1-8-4(6)2-7-3/h1-2H,(H2,6,8)
InChIKeyHWCKAMAVEWVBDO-UHFFFAOYSA-N
XLogP0.71
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.55
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Chloro-6-(1-piperazinyl)pyrazine
CID 107992
2-Amino-6-Chloropyrazine
CID 118458
Aminopyrazine
CID 78747
2-Amino-5-bromopyrazine
CID 599539
5-Bromo-3-chloropyrazin-2-amine
CID 46738202
2-Amino-3-chloropyrazine
CID 276224
3,5-Dichloropyrazin-2-amine
CID 11586346
2-Chloro-3-hydrazinopyrazine
CID 321430
2,6-Pyrazinediamine
CID 534688
Pyrazine-2,3-diamine
CID 284161
5-Bromo-6-chloropyrazin-2-amine
CID 18180207
3-Bromo-5-chloropyrazin-2-amine
CID 10488609

Frequently Asked Questions

What is the IUPAC name of 5-chloropyrazin-2-amine?
The IUPAC name of 5-chloropyrazin-2-amine (CID 12808419) is 5-chloropyrazin-2-amine.
What is the SMILES notation for 5-chloropyrazin-2-amine?
The canonical SMILES for 5-chloropyrazin-2-amine is Nc1cnc(Cl)cn1.
What is the InChIKey of 5-chloropyrazin-2-amine?
The InChIKey is HWCKAMAVEWVBDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4ClN3/c5-3-1-8-4(6)2-7-3/h1-2H,(H2,6,8).
What are the key properties of 5-chloropyrazin-2-amine?
5-chloropyrazin-2-amine has a molecular weight of 129.55 g/mol, XLogP of 0.71, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloropyrazin-2-amine is sourced from PubChem (CID 12808419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).