N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide

C18H20N2O2 — CID 70240593

IUPACN'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)c2cc(C)cc(C)c2)cc1
InChIInChI=1S/C18H20N2O2/c1-4-14-5-7-15(8-6-14)17(21)19-20-18(22)16-10-12(2)9-13(3)11-16/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyMAWCYONGPVNSHB-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.94
Rot. Bonds3

About N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide

N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide (PubChem CID 70240593) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide
PubChem CID70240593
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)c2cc(C)cc(C)c2)cc1
InChIInChI=1S/C18H20N2O2/c1-4-14-5-7-15(8-6-14)17(21)19-20-18(22)16-10-12(2)9-13(3)11-16/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyMAWCYONGPVNSHB-UHFFFAOYSA-N
XLogP2.94
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-ethylbenzoyl)-3-fluorobenzohydrazide
CID 7759216
4-ethyl-N'-[4-[(4-methylphenyl)sulfonylmethyl]benzoyl]benzohydrazide
CID 78888892
3-bromo-N-[(4-ethylphenyl)methyl]-5-methylbenzamide
CID 106899931
N-[(2S)-1-[2-(4-ethylbenzoyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide
CID 55942890
ethyl 4-[2-(4-ethylbenzoyl)hydrazinyl]-4-oxobutanoate
CID 9088083
ethane;4-ethyl-N-hydroxybenzamide
CID 142831550
ethane;4-ethyl-N-(4-methylphenyl)benzamide
CID 143234775
N-[2-[2-(4-fluorobenzoyl)hydrazinyl]-2-oxoethyl]-3,5-dimethylbenzamide
CID 86976055
4,5-dibromo-N'-(4-ethylbenzoyl)thiophene-2-carbohydrazide
CID 18291485
4-ethyl-N'-[(3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoyl]benzohydrazide
CID 9088080
N'-(4-ethylbenzoyl)-3-(trifluoromethyl)benzohydrazide
CID 7925712
N-(4-amino-2,6-dimethylphenyl)-4-ethylbenzamide
CID 50880299

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide?
The IUPAC name of N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide (CID 70240593) is N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide.
What is the SMILES notation for N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide?
The canonical SMILES for N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide is CCc1ccc(C(=O)NNC(=O)c2cc(C)cc(C)c2)cc1.
What is the InChIKey of N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide?
The InChIKey is MAWCYONGPVNSHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-4-14-5-7-15(8-6-14)17(21)19-20-18(22)16-10-12(2)9-13(3)11-16/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide?
N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide has a molecular weight of 296.37 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethylbenzoyl)-3,5-dimethylbenzohydrazide is sourced from PubChem (CID 70240593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).