2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide

C12H8Cl3N3O — CID 1483565

IUPAC2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide
SMILESO=C(NNc1cc(Cl)ccc1Cl)c1cccnc1Cl
InChIInChI=1S/C12H8Cl3N3O/c13-7-3-4-9(14)10(6-7)17-18-12(19)8-2-1-5-16-11(8)15/h1-6,17H,(H,18,19)
InChIKeyRZGHIZHJFLSTIC-UHFFFAOYSA-N
MW316.58 g/mol
LogP3.80
Rot. Bonds3

About 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide

2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide (PubChem CID 1483565) has the molecular formula C12H8Cl3N3O and a molecular weight of 316.58 g/mol. Its IUPAC name is 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide
PubChem CID1483565
Molecular FormulaC12H8Cl3N3O
Molecular Weight316.58 g/mol
Exact Mass314.97
IUPAC Name2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide
SMILESO=C(NNc1cc(Cl)ccc1Cl)c1cccnc1Cl
InChIInChI=1S/C12H8Cl3N3O/c13-7-3-4-9(14)10(6-7)17-18-12(19)8-2-1-5-16-11(8)15/h1-6,17H,(H,18,19)
InChIKeyRZGHIZHJFLSTIC-UHFFFAOYSA-N
XLogP3.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.58
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', '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'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide?
The IUPAC name of 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide (CID 1483565) is 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide?
The canonical SMILES for 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide is O=C(NNc1cc(Cl)ccc1Cl)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide?
The InChIKey is RZGHIZHJFLSTIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl3N3O/c13-7-3-4-9(14)10(6-7)17-18-12(19)8-2-1-5-16-11(8)15/h1-6,17H,(H,18,19).
What are the key properties of 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide?
2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide has a molecular weight of 316.58 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-(2,5-dichlorophenyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 1483565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).