N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide

C20H24N2O4 — CID 4945628

IUPACN'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)c2ccccc2OCC(C)C)cc1
InChIInChI=1S/C20H24N2O4/c1-14(2)12-26-18-7-5-4-6-17(18)20(24)22-21-19(23)13-25-16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyNKEUFSVOCRZLOK-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.87
Rot. Bonds7

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

N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide (PubChem CID 4945628) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide
PubChem CID4945628
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)c2ccccc2OCC(C)C)cc1
InChIInChI=1S/C20H24N2O4/c1-14(2)12-26-18-7-5-4-6-17(18)20(24)22-21-19(23)13-25-16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyNKEUFSVOCRZLOK-UHFFFAOYSA-N
XLogP2.87
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.87
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'-[2-(4-chloro-3-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide
CID 4945545
N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide
CID 4931603
2-hexoxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 4942278
2-(3-methylbutoxy)-N'-(2-phenoxyacetyl)benzohydrazide
CID 4943974
N-(4-ethoxyphenyl)-4-[2-[2-(2-methylpropoxy)benzoyl]hydrazinyl]-4-oxobutanamide
CID 4945641
N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]-2-(2-methylpropoxy)benzamide
CID 4946159
2-(2-methylpropoxy)-N'-(4-phenylmethoxybenzoyl)benzohydrazide
CID 4945737
N'-(3-ethoxypropanoyl)-2-(2-methylpropoxy)benzohydrazide
CID 17357941
2-(2-methoxyethoxy)-N-[[[2-(4-methylphenoxy)acetyl]amino]carbamothioyl]benzamide
CID 17356180
N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]-2-(2-methylpropoxy)benzamide
CID 4946157
5-[2-[3,5-bis[[[2-(2-methylpropoxy)benzoyl]amino]carbamoyl]phenoxy]ethoxy]-1-N',3-N'-bis[2-(2-methylpropoxy)benzoyl]benzene-1,3-dicarbohydrazide
CID 102166261
N'-[2-(4-methoxyphenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929179

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide?
The IUPAC name of N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide (CID 4945628) is N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide.
What is the SMILES notation for N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide?
The canonical SMILES for N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide is Cc1ccc(OCC(=O)NNC(=O)c2ccccc2OCC(C)C)cc1.
What is the InChIKey of N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide?
The InChIKey is NKEUFSVOCRZLOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-14(2)12-26-18-7-5-4-6-17(18)20(24)22-21-19(23)13-25-16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide?
N'-[2-(4-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide has a molecular weight of 356.42 g/mol, XLogP of 2.87, 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-(2-methylpropoxy)benzohydrazide is sourced from PubChem (CID 4945628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).