5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide

C20H17BrN2O4 — CID 17094356

IUPAC5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide
SMILESCOc1ccc(Br)cc1C(=O)NNC(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C20H17BrN2O4/c1-26-18-9-7-15(21)11-17(18)20(25)23-22-19(24)12-27-16-8-6-13-4-2-3-5-14(13)10-16/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeySGAXZGVYCTWLFK-UHFFFAOYSA-N
MW429.27 g/mol
LogP3.45
Rot. Bonds5

About 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide

5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide (PubChem CID 17094356) has the molecular formula C20H17BrN2O4 and a molecular weight of 429.27 g/mol. Its IUPAC name is 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide.

Molecular Properties

Compound Name5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide
PubChem CID17094356
Molecular FormulaC20H17BrN2O4
Molecular Weight429.27 g/mol
Exact Mass428.04
IUPAC Name5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide
SMILESCOc1ccc(Br)cc1C(=O)NNC(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C20H17BrN2O4/c1-26-18-9-7-15(21)11-17(18)20(25)23-22-19(24)12-27-16-8-6-13-4-2-3-5-14(13)10-16/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeySGAXZGVYCTWLFK-UHFFFAOYSA-N
XLogP3.45
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.27
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)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

5-bromo-2-(2-methoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
CID 17357334
N'-[2-(4-bromo-2-chlorophenoxy)acetyl]-2-naphthalen-2-yloxyacetohydrazide
CID 4632609
5-bromo-2-methoxy-N'-[2-(2-phenylphenoxy)acetyl]benzohydrazide
CID 17094335
5-bromo-2-methoxy-N-[[[2-(4-methoxyphenoxy)acetyl]amino]carbamothioyl]benzamide
CID 17094608
5-bromo-2-butoxy-N'-[2-(2-methoxyphenoxy)acetyl]benzohydrazide
CID 17350254
1-(2-methoxy-5-methylphenyl)-3-[(2-naphthalen-2-yloxyacetyl)amino]urea
CID 25237331
2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)acetohydrazide
CID 3108616
5-bromo-N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-2-ethoxybenzohydrazide
CID 17353038
5-bromo-2-methoxy-N'-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 17094394
5-bromo-2-butoxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 17350231
5-bromo-N'-[2-(4-methylphenoxy)acetyl]-2-propan-2-yloxybenzohydrazide
CID 17051707
5-bromo-N'-(2-indol-1-ylacetyl)-2-methoxybenzohydrazide
CID 17094435

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide?
The IUPAC name of 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide (CID 17094356) is 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide.
What is the SMILES notation for 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide?
The canonical SMILES for 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide is COc1ccc(Br)cc1C(=O)NNC(=O)COc1ccc2ccccc2c1.
What is the InChIKey of 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide?
The InChIKey is SGAXZGVYCTWLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17BrN2O4/c1-26-18-9-7-15(21)11-17(18)20(25)23-22-19(24)12-27-16-8-6-13-4-2-3-5-14(13)10-16/h2-11H,12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide?
5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide has a molecular weight of 429.27 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methoxy-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide is sourced from PubChem (CID 17094356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).