2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide

C15H16N2O2 — CID 43200038

IUPAC2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide
SMILESCc1cccc(C)c1Oc1ccccc1/C(N)=N/O
InChIInChI=1S/C15H16N2O2/c1-10-6-5-7-11(2)14(10)19-13-9-4-3-8-12(13)15(16)17-18/h3-9,18H,1-2H3,(H2,16,17)
InChIKeyXLGQZBMGNGNCIY-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.19
Rot. Bonds3

About 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide

2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide (PubChem CID 43200038) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide
PubChem CID43200038
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide
SMILESCc1cccc(C)c1Oc1ccccc1/C(N)=N/O
InChIInChI=1S/C15H16N2O2/c1-10-6-5-7-11(2)14(10)19-13-9-4-3-8-12(13)15(16)17-18/h3-9,18H,1-2H3,(H2,16,17)
InChIKeyXLGQZBMGNGNCIY-UHFFFAOYSA-N
XLogP3.19
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide 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-(2,6-dimethoxyphenoxy)-N'-hydroxybenzenecarboximidamide
CID 43200034
N'-hydroxy-2-methoxy-3-methylbenzenecarboximidamide
CID 88561585
N'-hydroxy-3-methyl-2-[(2-methyl-3-pyridinyl)oxy]benzenecarboximidamide
CID 107109864
N'-hydroxy-2-phenoxybenzenecarboximidamide
CID 51603436
2-(4-chloro-2-methylphenoxy)-N'-hydroxy-3-methylbenzenecarboximidamide
CID 107109614
2-(4-chloro-2-methylphenoxy)-N'-hydroxybenzenecarboximidamide
CID 43199996
N'-hydroxy-2-(4-methoxyphenoxy)benzenecarboximidamide
CID 43199994
N'-hydroxy-2-(2-propoxyphenoxy)benzenecarboximidamide
CID 43200019
2-(2,3-dimethylphenoxy)-N'-hydroxy-5-methylbenzenecarboximidamide
CID 107930140
2-(4-chlorophenoxy)-N'-hydroxybenzenecarboximidamide
CID 43199980
2-(3-ethylphenoxy)-N'-hydroxybenzenecarboximidamide
CID 43200048
2-(4-butylphenoxy)-N'-hydroxybenzenecarboximidamide
CID 115492682

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide (CID 43200038) is 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide is Cc1cccc(C)c1Oc1ccccc1/C(N)=N/O.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide?
The InChIKey is XLGQZBMGNGNCIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-6-5-7-11(2)14(10)19-13-9-4-3-8-12(13)15(16)17-18/h3-9,18H,1-2H3,(H2,16,17).
What are the key properties of 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide?
2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide has a molecular weight of 256.31 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-N'-hydroxybenzenecarboximidamide is sourced from PubChem (CID 43200038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).