5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide

C17H17ClN2O3 — CID 2469214

IUPAC5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(C)cc(C)c1
InChIInChI=1S/C17H17ClN2O3/c1-10-6-11(2)8-12(7-10)16(21)19-20-17(22)14-9-13(18)4-5-15(14)23-3/h4-9H,1-3H3,(H,19,21)(H,20,22)
InChIKeyVZQVDRHJCHWYIT-UHFFFAOYSA-N
MW332.79 g/mol
LogP3.04
Rot. Bonds3

About 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide

5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide (PubChem CID 2469214) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide.

Molecular Properties

Compound Name5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide
PubChem CID2469214
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC Name5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(C)cc(C)c1
InChIInChI=1S/C17H17ClN2O3/c1-10-6-11(2)8-12(7-10)16(21)19-20-17(22)14-9-13(18)4-5-15(14)23-3/h4-9H,1-3H3,(H,19,21)(H,20,22)
InChIKeyVZQVDRHJCHWYIT-UHFFFAOYSA-N
XLogP3.04
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
5-chloro-N'-(3,5-dimethoxybenzoyl)-2-methoxybenzohydrazide
CID 2091608
N'-(5-chloro-2-methoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
CID 4805458
4-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 29278893
5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide
CID 39708070
2,6-dichloro-N'-(5-chloro-2-methoxybenzoyl)benzohydrazide
CID 78775260
5-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxybenzohydrazide
CID 24636073
5-chloro-N-[(3,5-dimethylphenyl)carbamothioyl]-2-methoxybenzamide
CID 1121132
N'-(4-chloro-2-fluorobenzoyl)-3,4,5-trimethoxybenzohydrazide
CID 9084627
N'-(4-bromo-2-fluorobenzoyl)-5-chloro-2-methoxybenzohydrazide
CID 9085244
5-chloro-N-[2-[(3,5-dihydroxybenzoyl)amino]ethyl]-2-methoxybenzamide
CID 108540887
N'-(3-chlorobenzoyl)-2,5-dimethoxybenzohydrazide
CID 8637145

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide?
The IUPAC name of 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide (CID 2469214) is 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide.
What is the SMILES notation for 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide?
The canonical SMILES for 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide is COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(C)cc(C)c1.
What is the InChIKey of 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide?
The InChIKey is VZQVDRHJCHWYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-10-6-11(2)8-12(7-10)16(21)19-20-17(22)14-9-13(18)4-5-15(14)23-3/h4-9H,1-3H3,(H,19,21)(H,20,22).
What are the key properties of 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide?
5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide has a molecular weight of 332.79 g/mol, XLogP of 3.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N'-(3,5-dimethylbenzoyl)-2-methoxybenzohydrazide is sourced from PubChem (CID 2469214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).