N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide

C20H24N2O4 — CID 7600078

IUPACN'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2C)cc1OCC
InChIInChI=1S/C20H24N2O4/c1-5-25-17-10-8-15(12-18(17)26-6-2)19(23)21-22-20(24)16-9-7-13(3)11-14(16)4/h7-12H,5-6H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyLQBXHRBLRMTGGF-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.18
Rot. Bonds6

About N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide

N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide (PubChem CID 7600078) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide
PubChem CID7600078
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2C)cc1OCC
InChIInChI=1S/C20H24N2O4/c1-5-25-17-10-8-15(12-18(17)26-6-2)19(23)21-22-20(24)16-9-7-13(3)11-14(16)4/h7-12H,5-6H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyLQBXHRBLRMTGGF-UHFFFAOYSA-N
XLogP3.18
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[3-ethoxy-4-(2-methylpropoxy)benzoyl]-2,4-dimethylbenzohydrazide
CID 9276247
N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide
CID 7600016
3-chloro-N'-(2,4-dimethylbenzoyl)-5-ethoxy-4-propoxybenzohydrazide
CID 9276291
2,4-dimethyl-N'-(3-methylbenzoyl)benzohydrazide
CID 7600084
3-bromo-4-ethoxy-N'-(4-methylbenzoyl)benzohydrazide
CID 17073866
N-[1-(2,4-dimethylphenyl)propyl]-4-ethoxy-3-methylbenzamide
CID 133265324
N-[(2,4-dimethylphenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 46590873
3,4-diethoxy-N-(2-hydroxy-4-methylphenyl)benzamide
CID 26864885
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2,4-dimethylbenzoate
CID 7796100
N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
CID 25337421
N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide
CID 31715670
2,4-dimethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 7600117

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide?
The IUPAC name of N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide (CID 7600078) is N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide.
What is the SMILES notation for N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide?
The canonical SMILES for N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide is CCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2C)cc1OCC.
What is the InChIKey of N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide?
The InChIKey is LQBXHRBLRMTGGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-5-25-17-10-8-15(12-18(17)26-6-2)19(23)21-22-20(24)16-9-7-13(3)11-14(16)4/h7-12H,5-6H2,1-4H3,(H,21,23)(H,22,24).
What are the key properties of N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide?
N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide has a molecular weight of 356.42 g/mol, XLogP of 3.18, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide is sourced from PubChem (CID 7600078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).