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

C23H21N5O6 — CID 43070155

IUPAC2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2cccc(C(=O)NNC(=O)c3ccc(OC)cc3)n2)cc1
InChIInChI=1S/C23H21N5O6/c1-33-16-10-6-14(7-11-16)20(29)25-27-22(31)18-4-3-5-19(24-18)23(32)28-26-21(30)15-8-12-17(34-2)13-9-15/h3-13H,1-2H3,(H,25,29)(H,26,30)(H,27,31)(H,28,32)
InChIKeyWALKEXOVBPRIDY-UHFFFAOYSA-N
MW463.45 g/mol
LogP1.25
Rot. Bonds6

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

2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide (PubChem CID 43070155) has the molecular formula C23H21N5O6 and a molecular weight of 463.45 g/mol. Its IUPAC name is 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide.

Molecular Properties

Compound Name2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide
PubChem CID43070155
Molecular FormulaC23H21N5O6
Molecular Weight463.45 g/mol
Exact Mass463.15
IUPAC Name2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2cccc(C(=O)NNC(=O)c3ccc(OC)cc3)n2)cc1
InChIInChI=1S/C23H21N5O6/c1-33-16-10-6-14(7-11-16)20(29)25-27-22(31)18-4-3-5-19(24-18)23(32)28-26-21(30)15-8-12-17(34-2)13-9-15/h3-13H,1-2H3,(H,25,29)(H,26,30)(H,27,31)(H,28,32)
InChIKeyWALKEXOVBPRIDY-UHFFFAOYSA-N
XLogP1.25
TPSA147.75 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.45
LogP ≤ 51.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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-chlorobenzoyl)pyridine-2,6-dicarbohydrazide
CID 43063875
6-[[(4-methoxybenzoyl)amino]carbamoyl]pyridine-3-carboxylic acid
CID 167976818
4-methoxy-N-[1-[6-[N-[(4-methoxybenzoyl)amino]-C-methylcarbonimidoyl]-2-pyridinyl]ethylideneamino]benzamide
CID 155923428
1-N',4-N'-bis(4-methoxybenzoyl)butanedihydrazide
CID 3140699
N'-(4-methoxybenzoyl)-4-(trifluoromethyl)benzohydrazide
CID 2548088
N'-(4-methoxybenzoyl)-4-pyrrol-1-ylbenzohydrazide
CID 24536054
N-[4-[[(4-methoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1246678
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
4-[2-(4-methoxybenzoyl)hydrazinyl]-4-oxobut-2-enoate
CID 7036749
methyl N-(4-methoxybenzoyl)carbamate
CID 10420604
1-N',9-N'-bis(4-methoxybenzoyl)nonanedihydrazide
CID 3123941
1-(2-chlorophenyl)-3-[(4-methoxybenzoyl)amino]urea
CID 4825619

Frequently Asked Questions

What is the IUPAC name of 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide?
The IUPAC name of 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide (CID 43070155) is 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide.
What is the SMILES notation for 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide?
The canonical SMILES for 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide is COc1ccc(C(=O)NNC(=O)c2cccc(C(=O)NNC(=O)c3ccc(OC)cc3)n2)cc1.
What is the InChIKey of 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide?
The InChIKey is WALKEXOVBPRIDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O6/c1-33-16-10-6-14(7-11-16)20(29)25-27-22(31)18-4-3-5-19(24-18)23(32)28-26-21(30)15-8-12-17(34-2)13-9-15/h3-13H,1-2H3,(H,25,29)(H,26,30)(H,27,31)(H,28,32).
What are the key properties of 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide?
2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide has a molecular weight of 463.45 g/mol, XLogP of 1.25, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide is sourced from PubChem (CID 43070155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).