6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine

C9H12N6S — CID 80917852

IUPAC6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine
SMILESCC(Nc1cncc(NN)n1)c1nccs1
InChIInChI=1S/C9H12N6S/c1-6(9-12-2-3-16-9)13-7-4-11-5-8(14-7)15-10/h2-6H,10H2,1H3,(H2,13,14,15)
InChIKeyAMGGRYFAOICYER-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.39
Rot. Bonds4

About 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine

6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine (PubChem CID 80917852) has the molecular formula C9H12N6S and a molecular weight of 236.30 g/mol. Its IUPAC name is 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine
PubChem CID80917852
Molecular FormulaC9H12N6S
Molecular Weight236.30 g/mol
Exact Mass236.08
IUPAC Name6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine
SMILESCC(Nc1cncc(NN)n1)c1nccs1
InChIInChI=1S/C9H12N6S/c1-6(9-12-2-3-16-9)13-7-4-11-5-8(14-7)15-10/h2-6H,10H2,1H3,(H2,13,14,15)
InChIKeyAMGGRYFAOICYER-UHFFFAOYSA-N
XLogP1.39
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine?
The IUPAC name of 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine (CID 80917852) is 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine is CC(Nc1cncc(NN)n1)c1nccs1.
What is the InChIKey of 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine?
The InChIKey is AMGGRYFAOICYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6S/c1-6(9-12-2-3-16-9)13-7-4-11-5-8(14-7)15-10/h2-6H,10H2,1H3,(H2,13,14,15).
What are the key properties of 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine?
6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine has a molecular weight of 236.30 g/mol, XLogP of 1.39, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine is sourced from PubChem (CID 80917852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).