(6-prop-2-ynoxypyrazin-2-yl)hydrazine

C7H8N4O — CID 80914520

IUPAC(6-prop-2-ynoxypyrazin-2-yl)hydrazine
SMILESC#CCOc1cncc(NN)n1
InChIInChI=1S/C7H8N4O/c1-2-3-12-7-5-9-4-6(10-7)11-8/h1,4-5H,3,8H2,(H,10,11)
InChIKeyXBJHGDSSGVRTDN-UHFFFAOYSA-N
MW164.17 g/mol
LogP-0.23
Rot. Bonds3

About (6-prop-2-ynoxypyrazin-2-yl)hydrazine

(6-prop-2-ynoxypyrazin-2-yl)hydrazine (PubChem CID 80914520) has the molecular formula C7H8N4O and a molecular weight of 164.17 g/mol. Its IUPAC name is (6-prop-2-ynoxypyrazin-2-yl)hydrazine.

Molecular Properties

Compound Name(6-prop-2-ynoxypyrazin-2-yl)hydrazine
PubChem CID80914520
Molecular FormulaC7H8N4O
Molecular Weight164.17 g/mol
Exact Mass164.07
IUPAC Name(6-prop-2-ynoxypyrazin-2-yl)hydrazine
SMILESC#CCOc1cncc(NN)n1
InChIInChI=1S/C7H8N4O/c1-2-3-12-7-5-9-4-6(10-7)11-8/h1,4-5H,3,8H2,(H,10,11)
InChIKeyXBJHGDSSGVRTDN-UHFFFAOYSA-N
XLogP-0.23
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.17
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6-prop-2-ynoxypyrazin-2-yl)hydrazine?
The IUPAC name of (6-prop-2-ynoxypyrazin-2-yl)hydrazine (CID 80914520) is (6-prop-2-ynoxypyrazin-2-yl)hydrazine.
What is the SMILES notation for (6-prop-2-ynoxypyrazin-2-yl)hydrazine?
The canonical SMILES for (6-prop-2-ynoxypyrazin-2-yl)hydrazine is C#CCOc1cncc(NN)n1.
What is the InChIKey of (6-prop-2-ynoxypyrazin-2-yl)hydrazine?
The InChIKey is XBJHGDSSGVRTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O/c1-2-3-12-7-5-9-4-6(10-7)11-8/h1,4-5H,3,8H2,(H,10,11).
What are the key properties of (6-prop-2-ynoxypyrazin-2-yl)hydrazine?
(6-prop-2-ynoxypyrazin-2-yl)hydrazine has a molecular weight of 164.17 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-prop-2-ynoxypyrazin-2-yl)hydrazine is sourced from PubChem (CID 80914520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).