3-azido-5-methylpyrazin-2-amine

C5H6N6 — CID 11819208

IUPAC3-azido-5-methylpyrazin-2-amine
SMILESCc1cnc(N)c(N=[N+]=[N-])n1
InChIInChI=1S/C5H6N6/c1-3-2-8-4(6)5(9-3)10-11-7/h2H,1H3,(H2,6,8)
InChIKeyACBSHINDFPJCCH-UHFFFAOYSA-N
MW150.15 g/mol
LogP1.31
Rot. Bonds1

About 3-azido-5-methylpyrazin-2-amine

3-azido-5-methylpyrazin-2-amine (PubChem CID 11819208) has the molecular formula C5H6N6 and a molecular weight of 150.15 g/mol. Its IUPAC name is 3-azido-5-methylpyrazin-2-amine.

Molecular Properties

Compound Name3-azido-5-methylpyrazin-2-amine
PubChem CID11819208
Molecular FormulaC5H6N6
Molecular Weight150.15 g/mol
Exact Mass150.07
IUPAC Name3-azido-5-methylpyrazin-2-amine
SMILESCc1cnc(N)c(N=[N+]=[N-])n1
InChIInChI=1S/C5H6N6/c1-3-2-8-4(6)5(9-3)10-11-7/h2H,1H3,(H2,6,8)
InChIKeyACBSHINDFPJCCH-UHFFFAOYSA-N
XLogP1.31
TPSA100.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.15
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-azido-5-methylpyrazin-2-amine?
The IUPAC name of 3-azido-5-methylpyrazin-2-amine (CID 11819208) is 3-azido-5-methylpyrazin-2-amine.
What is the SMILES notation for 3-azido-5-methylpyrazin-2-amine?
The canonical SMILES for 3-azido-5-methylpyrazin-2-amine is Cc1cnc(N)c(N=[N+]=[N-])n1.
What is the InChIKey of 3-azido-5-methylpyrazin-2-amine?
The InChIKey is ACBSHINDFPJCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N6/c1-3-2-8-4(6)5(9-3)10-11-7/h2H,1H3,(H2,6,8).
What are the key properties of 3-azido-5-methylpyrazin-2-amine?
3-azido-5-methylpyrazin-2-amine has a molecular weight of 150.15 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azido-5-methylpyrazin-2-amine is sourced from PubChem (CID 11819208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).