2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide

C21H15Cl2N5O4 — CID 43063875

IUPAC2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide
SMILESO=C(NNC(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)n1)c1ccc(Cl)cc1
InChIInChI=1S/C21H15Cl2N5O4/c22-14-8-4-12(5-9-14)18(29)25-27-20(31)16-2-1-3-17(24-16)21(32)28-26-19(30)13-6-10-15(23)11-7-13/h1-11H,(H,25,29)(H,26,30)(H,27,31)(H,28,32)
InChIKeyZIZWDOBLJOEOAB-UHFFFAOYSA-N
MW472.29 g/mol
LogP2.54
Rot. Bonds4

About 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide

2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide (PubChem CID 43063875) has the molecular formula C21H15Cl2N5O4 and a molecular weight of 472.29 g/mol. Its IUPAC name is 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide.

Molecular Properties

Compound Name2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide
PubChem CID43063875
Molecular FormulaC21H15Cl2N5O4
Molecular Weight472.29 g/mol
Exact Mass471.05
IUPAC Name2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide
SMILESO=C(NNC(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)n1)c1ccc(Cl)cc1
InChIInChI=1S/C21H15Cl2N5O4/c22-14-8-4-12(5-9-14)18(29)25-27-20(31)16-2-1-3-17(24-16)21(32)28-26-19(30)13-6-10-15(23)11-7-13/h1-11H,(H,25,29)(H,26,30)(H,27,31)(H,28,32)
InChIKeyZIZWDOBLJOEOAB-UHFFFAOYSA-N
XLogP2.54
TPSA129.29 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500472.29
LogP ≤ 52.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide
CID 43070155
N'-(4-chlorobenzoyl)pyridine-4-carbohydrazide
CID 960057
N'-(4-chlorobenzoyl)-2-phenyl-1,3-thiazole-4-carbohydrazide
CID 55386497
N'-acetyl-4-chlorobenzohydrazide
CID 799230
4-amino-N'-(4-chlorobenzoyl)benzohydrazide
CID 785216
2-N,6-N-bis(2,5-dichlorophenyl)pyridine-2,6-dicarboxamide
CID 4104861
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N'-(4-chlorobenzoyl)-3-methylbenzohydrazide
CID 959739
N'-(4-chlorobenzoyl)-4-pyridin-4-ylbenzohydrazide
CID 58858336
4-chloro-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
CID 3396166
N-[4-[[(4-chlorobenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1100705
N'-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]pyridine-2-carbohydrazide
CID 24537705

Frequently Asked Questions

What is the IUPAC name of 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide?
The IUPAC name of 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide (CID 43063875) is 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide.
What is the SMILES notation for 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide?
The canonical SMILES for 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide is O=C(NNC(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)n1)c1ccc(Cl)cc1.
What is the InChIKey of 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide?
The InChIKey is ZIZWDOBLJOEOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15Cl2N5O4/c22-14-8-4-12(5-9-14)18(29)25-27-20(31)16-2-1-3-17(24-16)21(32)28-26-19(30)13-6-10-15(23)11-7-13/h1-11H,(H,25,29)(H,26,30)(H,27,31)(H,28,32).
What are the key properties of 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide?
2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide has a molecular weight of 472.29 g/mol, XLogP of 2.54, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N',6-N'-bis(4-chlorobenzoyl)pyridine-2,6-dicarbohydrazide is sourced from PubChem (CID 43063875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).