N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide

C18H20N2O3 — CID 7600016

IUPACN'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2C)cc1
InChIInChI=1S/C18H20N2O3/c1-4-23-15-8-6-14(7-9-15)17(21)19-20-18(22)16-10-5-12(2)11-13(16)3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyQLWMXRFZYNNSNM-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.78
Rot. Bonds4

About N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide

N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide (PubChem CID 7600016) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide
PubChem CID7600016
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2C)cc1
InChIInChI=1S/C18H20N2O3/c1-4-23-15-8-6-14(7-9-15)17(21)19-20-18(22)16-10-5-12(2)11-13(16)3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyQLWMXRFZYNNSNM-UHFFFAOYSA-N
XLogP2.78
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.78
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

N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide
CID 7600078
N'-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-2,4-dimethylbenzohydrazide
CID 9276376
(2,4-dimethylphenyl)-(4-ethoxyphenyl)methanone
CID 43160127
N'-[2-(2,5-dimethylphenoxy)acetyl]-4-ethoxybenzohydrazide
CID 26845933
N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-4-ethoxybenzamide
CID 94843664
N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide
CID 8915144
N'-[3-ethoxy-4-(2-methylpropoxy)benzoyl]-2,4-dimethylbenzohydrazide
CID 9276247
N'-[2-(2,5-dimethylphenyl)sulfanylacetyl]-4-ethoxybenzohydrazide
CID 9492725
N'-(4-ethoxybenzoyl)-6-(3-methylphenyl)-2-oxo-1H-pyridine-3-carbohydrazide
CID 55786733
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
N'-(4-ethoxybenzoyl)-2,5-difluorobenzohydrazide
CID 30485626
5-chloro-N'-(4-ethoxybenzoyl)-2-fluorobenzohydrazide
CID 9086466

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide?
The IUPAC name of N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide (CID 7600016) is N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide.
What is the SMILES notation for N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide?
The canonical SMILES for N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide is CCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2C)cc1.
What is the InChIKey of N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide?
The InChIKey is QLWMXRFZYNNSNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-4-23-15-8-6-14(7-9-15)17(21)19-20-18(22)16-10-5-12(2)11-13(16)3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide?
N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide has a molecular weight of 312.37 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide is sourced from PubChem (CID 7600016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).