N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride

C14H15ClN2O2 — CID 117067574

IUPACN'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride
SMILESCl.N/C(COc1ccccc1-c1ccccc1)=N\O
InChIInChI=1S/C14H14N2O2.ClH/c15-14(16-17)10-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11;/h1-9,17H,10H2,(H2,15,16);1H
InChIKeyFDLWICLTKCVKTC-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.90
Rot. Bonds4

About N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride

N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride (PubChem CID 117067574) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride.

Molecular Properties

Compound NameN'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride
PubChem CID117067574
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC NameN'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride
SMILESCl.N/C(COc1ccccc1-c1ccccc1)=N\O
InChIInChI=1S/C14H14N2O2.ClH/c15-14(16-17)10-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11;/h1-9,17H,10H2,(H2,15,16);1H
InChIKeyFDLWICLTKCVKTC-UHFFFAOYSA-N
XLogP2.90
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.90
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'}

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Related Compounds

N'-hydroxy-4-(2-phenylphenoxy)butanimidamide
CID 24695153
N'-hydroxy-2-[2-(hydroxymethyl)phenoxy]ethanimidamide
CID 77003791
2-(2-ethylphenoxy)-N'-hydroxyethanimidamide
CID 43364299
1-(2-methylprop-2-enoxy)-2-phenylbenzene
CID 70267118
N'-hydroxy-3-(2-phenylphenoxy)pentanimidamide
CID 43175259
2-(2-phenylphenoxy)ethanamine;hydrochloride
CID 2876913
3-(2-phenylphenoxy)propanethioamide
CID 7745595
[(2R)-1-amino-1-oxopropan-2-yl] 2-(2-phenylphenoxy)acetate
CID 8919855
4-(2-phenylphenoxy)butan-1-amine;hydrochloride
CID 3046513
N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide
CID 5420157
1-phenyl-2-(2,2,2-trifluoroethoxy)benzene
CID 86122224
2-methyl-1-[2-(2-phenylphenoxy)ethyl]guanidine
CID 110917179

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride?
The IUPAC name of N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride (CID 117067574) is N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride.
What is the SMILES notation for N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride?
The canonical SMILES for N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride is Cl.N/C(COc1ccccc1-c1ccccc1)=N\O.
What is the InChIKey of N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride?
The InChIKey is FDLWICLTKCVKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2.ClH/c15-14(16-17)10-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11;/h1-9,17H,10H2,(H2,15,16);1H.
What are the key properties of N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride?
N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride has a molecular weight of 278.74 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-(2-phenylphenoxy)ethanimidamide;hydrochloride is sourced from PubChem (CID 117067574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).