2,3,5-trichloro-6-hydrazinylpyridin-4-amine

C5H5Cl3N4 — CID 2388444

IUPAC2,3,5-trichloro-6-hydrazinylpyridin-4-amine
SMILESNNc1nc(Cl)c(Cl)c(N)c1Cl
InChIInChI=1S/C5H5Cl3N4/c6-1-3(9)2(7)5(12-10)11-4(1)8/h10H2,(H3,9,11,12)
InChIKeyCTWTWTAESWKWLW-UHFFFAOYSA-N
MW227.48 g/mol
LogP1.91
Rot. Bonds1

About 2,3,5-trichloro-6-hydrazinylpyridin-4-amine

2,3,5-trichloro-6-hydrazinylpyridin-4-amine (PubChem CID 2388444) has the molecular formula C5H5Cl3N4 and a molecular weight of 227.48 g/mol. Its IUPAC name is 2,3,5-trichloro-6-hydrazinylpyridin-4-amine.

Molecular Properties

Compound Name2,3,5-trichloro-6-hydrazinylpyridin-4-amine
PubChem CID2388444
Molecular FormulaC5H5Cl3N4
Molecular Weight227.48 g/mol
Exact Mass225.96
IUPAC Name2,3,5-trichloro-6-hydrazinylpyridin-4-amine
SMILESNNc1nc(Cl)c(Cl)c(N)c1Cl
InChIInChI=1S/C5H5Cl3N4/c6-1-3(9)2(7)5(12-10)11-4(1)8/h10H2,(H3,9,11,12)
InChIKeyCTWTWTAESWKWLW-UHFFFAOYSA-N
XLogP1.91
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.48
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'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 2,3,5-trichloro-6-hydrazinylpyridin-4-amine?
The IUPAC name of 2,3,5-trichloro-6-hydrazinylpyridin-4-amine (CID 2388444) is 2,3,5-trichloro-6-hydrazinylpyridin-4-amine.
What is the SMILES notation for 2,3,5-trichloro-6-hydrazinylpyridin-4-amine?
The canonical SMILES for 2,3,5-trichloro-6-hydrazinylpyridin-4-amine is NNc1nc(Cl)c(Cl)c(N)c1Cl.
What is the InChIKey of 2,3,5-trichloro-6-hydrazinylpyridin-4-amine?
The InChIKey is CTWTWTAESWKWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5Cl3N4/c6-1-3(9)2(7)5(12-10)11-4(1)8/h10H2,(H3,9,11,12).
What are the key properties of 2,3,5-trichloro-6-hydrazinylpyridin-4-amine?
2,3,5-trichloro-6-hydrazinylpyridin-4-amine has a molecular weight of 227.48 g/mol, XLogP of 1.91, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trichloro-6-hydrazinylpyridin-4-amine is sourced from PubChem (CID 2388444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).