2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide

C15H15BrN2O2 — CID 63570205

IUPAC2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide
SMILESCc1cc(Br)ccc1OC(C(=O)NN)c1ccccc1
InChIInChI=1S/C15H15BrN2O2/c1-10-9-12(16)7-8-13(10)20-14(15(19)18-17)11-5-3-2-4-6-11/h2-9,14H,17H2,1H3,(H,18,19)
InChIKeyFDIZSZRUENZNPC-UHFFFAOYSA-N
MW335.20 g/mol
LogP2.87
Rot. Bonds4

About 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide

2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide (PubChem CID 63570205) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide.

Molecular Properties

Compound Name2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide
PubChem CID63570205
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC Name2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide
SMILESCc1cc(Br)ccc1OC(C(=O)NN)c1ccccc1
InChIInChI=1S/C15H15BrN2O2/c1-10-9-12(16)7-8-13(10)20-14(15(19)18-17)11-5-3-2-4-6-11/h2-9,14H,17H2,1H3,(H,18,19)
InChIKeyFDIZSZRUENZNPC-UHFFFAOYSA-N
XLogP2.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide 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-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide
CID 63569668
2-(3,5-dimethylphenoxy)-2-phenylacetohydrazide
CID 63576169
2-(2-fluorophenoxy)-2-phenylacetohydrazide
CID 63576514
2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide
CID 63576718
(2S)-2-(4-bromo-2-methylphenoxy)propanoic acid
CID 42316822
2-(2-fluoro-4-formylphenoxy)-2-phenylacetohydrazide
CID 107693702
2-[2-[(4-bromo-2-methylphenoxy)methyl]phenyl]acetohydrazide
CID 115465253
(3R)-3-(4-bromo-2-methylphenoxy)butanoic acid
CID 103548018
2-phenyl-2-propoxyacetohydrazide
CID 63569629
N-[2-(4-bromo-2-methylphenoxy)-2-phenylethyl]cyclopropanamine
CID 63497564
(2R)-2-(3-bromophenoxy)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenylacetamide
CID 51958231
2-(3-bromophenyl)propanehydrazide
CID 116843936

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide?
The IUPAC name of 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide (CID 63570205) is 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide.
What is the SMILES notation for 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide?
The canonical SMILES for 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide is Cc1cc(Br)ccc1OC(C(=O)NN)c1ccccc1.
What is the InChIKey of 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide?
The InChIKey is FDIZSZRUENZNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c1-10-9-12(16)7-8-13(10)20-14(15(19)18-17)11-5-3-2-4-6-11/h2-9,14H,17H2,1H3,(H,18,19).
What are the key properties of 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide?
2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide has a molecular weight of 335.20 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide is sourced from PubChem (CID 63570205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).