3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide

C18H20N2O4 — CID 4879587

IUPAC3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
SMILESCC(C)c1ccccc1OCC(=O)NNC(=O)c1cccc(O)c1
InChIInChI=1S/C18H20N2O4/c1-12(2)15-8-3-4-9-16(15)24-11-17(22)19-20-18(23)13-6-5-7-14(21)10-13/h3-10,12,21H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyQNHCHZMYAAHHEW-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.36
Rot. Bonds5

About 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide

3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide (PubChem CID 4879587) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
PubChem CID4879587
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Name3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
SMILESCC(C)c1ccccc1OCC(=O)NNC(=O)c1cccc(O)c1
InChIInChI=1S/C18H20N2O4/c1-12(2)15-8-3-4-9-16(15)24-11-17(22)19-20-18(23)13-6-5-7-14(21)10-13/h3-10,12,21H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyQNHCHZMYAAHHEW-UHFFFAOYSA-N
XLogP2.36
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]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

N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 922574
3-butoxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 4956700
1-N',5-N'-bis[2-(2-propan-2-ylphenoxy)acetyl]pentanedihydrazide
CID 3554714
N'-[2-(4-bromo-2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 17189087
2-(3-methylphenoxy)-N'-[2-(2-propan-2-ylphenoxy)acetyl]acetohydrazide
CID 3493807
N-propan-2-yl-2-(2-propan-2-ylphenoxy)acetamide
CID 19168088
3-[[[2-(2-butan-2-ylphenoxy)acetyl]amino]carbamoyl]-N,N-diethylbenzenesulfonamide
CID 55486046
N-(2,6-dichlorophenyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 54785981
N'-[2-(2-propan-2-ylphenoxy)acetyl]hexanehydrazide
CID 4955562
N'-[2-(2-butan-2-ylphenoxy)acetyl]-3,4,5-triethoxybenzohydrazide
CID 55486518
1-phenyl-2-(2-propan-2-ylphenoxy)ethanone
CID 43413868
5-bromo-2-propan-2-yloxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 17051675

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide?
The IUPAC name of 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide (CID 4879587) is 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide?
The canonical SMILES for 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide is CC(C)c1ccccc1OCC(=O)NNC(=O)c1cccc(O)c1.
What is the InChIKey of 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide?
The InChIKey is QNHCHZMYAAHHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-12(2)15-8-3-4-9-16(15)24-11-17(22)19-20-18(23)13-6-5-7-14(21)10-13/h3-10,12,21H,11H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide?
3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide has a molecular weight of 328.37 g/mol, XLogP of 2.36, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 4879587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).