4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide

C22H28N2O3 — CID 55792665

IUPAC4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)C(C)Oc2cc(C)ccc2C(C)C)cc1
InChIInChI=1S/C22H28N2O3/c1-6-17-8-10-18(11-9-17)22(26)24-23-21(25)16(5)27-20-13-15(4)7-12-19(20)14(2)3/h7-14,16H,6H2,1-5H3,(H,23,25)(H,24,26)
InChIKeyQNKQCWGFWSLLNY-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.91
Rot. Bonds6

About 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide

4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide (PubChem CID 55792665) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide.

Molecular Properties

Compound Name4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide
PubChem CID55792665
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)C(C)Oc2cc(C)ccc2C(C)C)cc1
InChIInChI=1S/C22H28N2O3/c1-6-17-8-10-18(11-9-17)22(26)24-23-21(25)16(5)27-20-13-15(4)7-12-19(20)14(2)3/h7-14,16H,6H2,1-5H3,(H,23,25)(H,24,26)
InChIKeyQNKQCWGFWSLLNY-UHFFFAOYSA-N
XLogP3.91
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 4-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzoate
CID 133162806
N'-[(2S)-2-(4-ethylphenoxy)propanoyl]-3-methylbenzohydrazide
CID 9237504
4-ethyl-N'-[2-(3-propan-2-ylphenoxy)propanoyl]benzohydrazide
CID 55792697
(2R)-N-[(2R)-3-methylbutan-2-yl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100572381
N-[(4-chlorophenyl)methyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133235431
2-(5-methyl-2-propan-2-ylphenoxy)pentan-3-one
CID 64866513
N-[(2S)-1-[2-(4-ethylbenzoyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide
CID 55942890
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133186748
2-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]butanoic acid
CID 119223242
N'-[2-(4-ethylphenoxy)propanoyl]-4-prop-2-enoxybenzohydrazide
CID 4953506
2-(5-methyl-2-propan-2-ylphenoxy)-N-prop-2-ynylpropanamide
CID 134038041
(2R)-2-(5-methyl-2-propan-2-ylphenoxy)-N-(3-propan-2-yloxypropyl)propanamide
CID 94180255

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide?
The IUPAC name of 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide (CID 55792665) is 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide.
What is the SMILES notation for 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide?
The canonical SMILES for 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide is CCc1ccc(C(=O)NNC(=O)C(C)Oc2cc(C)ccc2C(C)C)cc1.
What is the InChIKey of 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide?
The InChIKey is QNKQCWGFWSLLNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-6-17-8-10-18(11-9-17)22(26)24-23-21(25)16(5)27-20-13-15(4)7-12-19(20)14(2)3/h7-14,16H,6H2,1-5H3,(H,23,25)(H,24,26).
What are the key properties of 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide?
4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide has a molecular weight of 368.48 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N'-[2-(5-methyl-2-propan-2-ylphenoxy)propanoyl]benzohydrazide is sourced from PubChem (CID 55792665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).