2-chloro-6-hydrazinylpyridine-4-carbohydrazide

C6H8ClN5O — CID 3029019

IUPAC2-chloro-6-hydrazinylpyridine-4-carbohydrazide
SMILESNNC(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C6H8ClN5O/c7-4-1-3(6(13)12-9)2-5(10-4)11-8/h1-2H,8-9H2,(H,10,11)(H,12,13)
InChIKeyFHQIAPYAUMBQDO-UHFFFAOYSA-N
MW201.62 g/mol
LogP-0.38
Rot. Bonds2

About 2-chloro-6-hydrazinylpyridine-4-carbohydrazide

2-chloro-6-hydrazinylpyridine-4-carbohydrazide (PubChem CID 3029019) has the molecular formula C6H8ClN5O and a molecular weight of 201.62 g/mol. Its IUPAC name is 2-chloro-6-hydrazinylpyridine-4-carbohydrazide.

Molecular Properties

Compound Name2-chloro-6-hydrazinylpyridine-4-carbohydrazide
PubChem CID3029019
Molecular FormulaC6H8ClN5O
Molecular Weight201.62 g/mol
Exact Mass201.04
IUPAC Name2-chloro-6-hydrazinylpyridine-4-carbohydrazide
SMILESNNC(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C6H8ClN5O/c7-4-1-3(6(13)12-9)2-5(10-4)11-8/h1-2H,8-9H2,(H,10,11)(H,12,13)
InChIKeyFHQIAPYAUMBQDO-UHFFFAOYSA-N
XLogP-0.38
TPSA106.06 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.62
LogP ≤ 5-0.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'acyl_hydrazine', '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-chloro-6-hydrazinylpyridine-4-carbohydrazide?
The IUPAC name of 2-chloro-6-hydrazinylpyridine-4-carbohydrazide (CID 3029019) is 2-chloro-6-hydrazinylpyridine-4-carbohydrazide.
What is the SMILES notation for 2-chloro-6-hydrazinylpyridine-4-carbohydrazide?
The canonical SMILES for 2-chloro-6-hydrazinylpyridine-4-carbohydrazide is NNC(=O)c1cc(Cl)nc(NN)c1.
What is the InChIKey of 2-chloro-6-hydrazinylpyridine-4-carbohydrazide?
The InChIKey is FHQIAPYAUMBQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN5O/c7-4-1-3(6(13)12-9)2-5(10-4)11-8/h1-2H,8-9H2,(H,10,11)(H,12,13).
What are the key properties of 2-chloro-6-hydrazinylpyridine-4-carbohydrazide?
2-chloro-6-hydrazinylpyridine-4-carbohydrazide has a molecular weight of 201.62 g/mol, XLogP of -0.38, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydrazinylpyridine-4-carbohydrazide is sourced from PubChem (CID 3029019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).