2-[(2,4-dimethylphenoxy)methyl]benzohydrazide

C16H18N2O2 — CID 63576319

IUPAC2-[(2,4-dimethylphenoxy)methyl]benzohydrazide
SMILESCc1ccc(OCc2ccccc2C(=O)NN)c(C)c1
InChIInChI=1S/C16H18N2O2/c1-11-7-8-15(12(2)9-11)20-10-13-5-3-4-6-14(13)16(19)18-17/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyUYVVARYVONRBSD-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.49
Rot. Bonds4

About 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide

2-[(2,4-dimethylphenoxy)methyl]benzohydrazide (PubChem CID 63576319) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide.

Molecular Properties

Compound Name2-[(2,4-dimethylphenoxy)methyl]benzohydrazide
PubChem CID63576319
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-[(2,4-dimethylphenoxy)methyl]benzohydrazide
SMILESCc1ccc(OCc2ccccc2C(=O)NN)c(C)c1
InChIInChI=1S/C16H18N2O2/c1-11-7-8-15(12(2)9-11)20-10-13-5-3-4-6-14(13)16(19)18-17/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyUYVVARYVONRBSD-UHFFFAOYSA-N
XLogP2.49
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.49
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-[(2,4-dimethylphenoxy)methyl]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

2-[(2-methoxyphenoxy)methyl]benzohydrazide
CID 63576535
2-[(5-cyano-2-methylphenoxy)methyl]benzohydrazide
CID 107661586
2-[[2-(hydroxymethyl)phenoxy]methyl]benzohydrazide
CID 63680399
3-bromo-4-[(2,4-dimethylphenoxy)methyl]benzohydrazide
CID 102774285
(2E)-2-[2-[(2,4-dimethylphenoxy)methyl]phenyl]-2-methoxyiminoacetyl chloride
CID 22878398
2-[(2-chlorophenoxy)methyl]benzohydrazide
CID 63576691
methyl 2-amino-6-[(2,4-dimethylphenoxy)methyl]benzoate
CID 104825290
2-[(4-fluoro-2-methylphenoxy)methyl]benzoyl chloride
CID 19755755
methyl 2-[(2,4-dimethylphenoxy)methyl]-3-ethylbenzoate
CID 121367533
2-[2-[(2,5-dimethylphenoxy)methyl]phenyl]-2-methoxyiminoacetohydrazide
CID 86584675
2-[(2,4-dimethylphenoxy)methyl]benzenethiol
CID 54329729
methyl 2-[(2-bromo-4-methylphenoxy)methyl]benzoate
CID 82976395

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide?
The IUPAC name of 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide (CID 63576319) is 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide.
What is the SMILES notation for 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide?
The canonical SMILES for 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide is Cc1ccc(OCc2ccccc2C(=O)NN)c(C)c1.
What is the InChIKey of 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide?
The InChIKey is UYVVARYVONRBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-7-8-15(12(2)9-11)20-10-13-5-3-4-6-14(13)16(19)18-17/h3-9H,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide?
2-[(2,4-dimethylphenoxy)methyl]benzohydrazide has a molecular weight of 270.33 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethylphenoxy)methyl]benzohydrazide is sourced from PubChem (CID 63576319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).