2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide

C8H9Cl2N3O — CID 3632034

IUPAC2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide
SMILESCC(Cl)C(=O)NNc1cccc(Cl)n1
InChIInChI=1S/C8H9Cl2N3O/c1-5(9)8(14)13-12-7-4-2-3-6(10)11-7/h2-5H,1H3,(H,11,12)(H,13,14)
InChIKeyZXJRKLKRLVRTFE-UHFFFAOYSA-N
MW234.09 g/mol
LogP1.81
Rot. Bonds3

About 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide

2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide (PubChem CID 3632034) has the molecular formula C8H9Cl2N3O and a molecular weight of 234.09 g/mol. Its IUPAC name is 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide.

Molecular Properties

Compound Name2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide
PubChem CID3632034
Molecular FormulaC8H9Cl2N3O
Molecular Weight234.09 g/mol
Exact Mass233.01
IUPAC Name2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide
SMILESCC(Cl)C(=O)NNc1cccc(Cl)n1
InChIInChI=1S/C8H9Cl2N3O/c1-5(9)8(14)13-12-7-4-2-3-6(10)11-7/h2-5H,1H3,(H,11,12)(H,13,14)
InChIKeyZXJRKLKRLVRTFE-UHFFFAOYSA-N
XLogP1.81
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.09
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', '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-N'-(6-chloro-2-pyridinyl)propanehydrazide?
The IUPAC name of 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide (CID 3632034) is 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide.
What is the SMILES notation for 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide?
The canonical SMILES for 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide is CC(Cl)C(=O)NNc1cccc(Cl)n1.
What is the InChIKey of 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide?
The InChIKey is ZXJRKLKRLVRTFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Cl2N3O/c1-5(9)8(14)13-12-7-4-2-3-6(10)11-7/h2-5H,1H3,(H,11,12)(H,13,14).
What are the key properties of 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide?
2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide has a molecular weight of 234.09 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-(6-chloro-2-pyridinyl)propanehydrazide is sourced from PubChem (CID 3632034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).