N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide

C19H22N2O4 — CID 4931603

IUPACN'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide
SMILESCCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1
InChIInChI=1S/C19H22N2O4/c1-3-12-24-17-7-5-4-6-16(17)19(23)21-20-18(22)13-25-15-10-8-14(2)9-11-15/h4-11H,3,12-13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeySHVYBCHLGRPBKZ-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.62
Rot. Bonds7

About N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide

N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide (PubChem CID 4931603) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide
PubChem CID4931603
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide
SMILESCCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1
InChIInChI=1S/C19H22N2O4/c1-3-12-24-17-7-5-4-6-16(17)19(23)21-20-18(22)13-25-15-10-8-14(2)9-11-15/h4-11H,3,12-13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeySHVYBCHLGRPBKZ-UHFFFAOYSA-N
XLogP2.62
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide 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

2-hexoxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 4942278
N'-[2-(3-methylphenoxy)acetyl]-2-propoxybenzohydrazide
CID 4931604
N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide
CID 4945628
2-butoxy-N'-[2-(4-ethylphenoxy)acetyl]benzohydrazide
CID 4941258
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
N'-[2-(4-methoxyphenoxy)acetyl]-2-pentoxybenzohydrazide
CID 4946756
ethyl 4-[2-[2-[2-(2-methoxyethoxy)benzoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17355650
2-(2-methoxyethoxy)-N-[[[2-(4-methylphenoxy)acetyl]amino]carbamothioyl]benzamide
CID 17356180
propyl 4-[2-[2-[2-(2-ethoxyethoxy)benzoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17122909
5-bromo-2-butoxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 17350231
N-[[[2-(3,5-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-propoxybenzamide
CID 4949293
2-(3-methylbutoxy)-N'-(2-phenoxyacetyl)benzohydrazide
CID 4943974

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide?
The IUPAC name of N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide (CID 4931603) is N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide.
What is the SMILES notation for N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide?
The canonical SMILES for N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide is CCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1.
What is the InChIKey of N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide?
The InChIKey is SHVYBCHLGRPBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-3-12-24-17-7-5-4-6-16(17)19(23)21-20-18(22)13-25-15-10-8-14(2)9-11-15/h4-11H,3,12-13H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide?
N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide has a molecular weight of 342.40 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide is sourced from PubChem (CID 4931603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).