N'-hydroxy-3-phenoxypentanimidamide

C11H16N2O2 — CID 43368248

IUPACN'-hydroxy-3-phenoxypentanimidamide
SMILESCCC(C/C(N)=N/O)Oc1ccccc1
InChIInChI=1S/C11H16N2O2/c1-2-9(8-11(12)13-14)15-10-6-4-3-5-7-10/h3-7,9,14H,2,8H2,1H3,(H2,12,13)
InChIKeyFBYAISGTWKZDIA-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.98
Rot. Bonds5

About N'-hydroxy-3-phenoxypentanimidamide

N'-hydroxy-3-phenoxypentanimidamide (PubChem CID 43368248) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N'-hydroxy-3-phenoxypentanimidamide.

Molecular Properties

Compound NameN'-hydroxy-3-phenoxypentanimidamide
PubChem CID43368248
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN'-hydroxy-3-phenoxypentanimidamide
SMILESCCC(C/C(N)=N/O)Oc1ccccc1
InChIInChI=1S/C11H16N2O2/c1-2-9(8-11(12)13-14)15-10-6-4-3-5-7-10/h3-7,9,14H,2,8H2,1H3,(H2,12,13)
InChIKeyFBYAISGTWKZDIA-UHFFFAOYSA-N
XLogP1.98
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.98
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-3-(2-phenylphenoxy)pentanimidamide
CID 43175259
3-(4-chloronaphthalen-1-yl)oxy-N'-hydroxypentanimidamide
CID 43804670
3-(2,3-dichlorophenoxy)-N'-hydroxypentanimidamide
CID 43175295
3-(4-chloro-2-methylphenoxy)-N'-hydroxypentanimidamide
CID 43368320
3-(2-bromo-4-fluorophenoxy)-N'-hydroxypentanimidamide
CID 43368616
4-phenoxyhexanoic acid
CID 166708960
3-[2-ethoxyethyl(methyl)amino]-N'-hydroxy-3-phenylpropanimidamide
CID 81055642
1-phenoxybutane-1,2-diol
CID 19866542
hex-5-en-3-yloxybenzene
CID 174866865
N'-hydroxy-3-[methyl(pentan-3-yl)amino]-3-phenylpropanimidamide
CID 76949064
N'-hydroxy-3-phenyl-3-propoxypropanimidamide
CID 115001465
3-(4-methylphenoxy)pentanethioamide
CID 43368539

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-3-phenoxypentanimidamide?
The IUPAC name of N'-hydroxy-3-phenoxypentanimidamide (CID 43368248) is N'-hydroxy-3-phenoxypentanimidamide.
What is the SMILES notation for N'-hydroxy-3-phenoxypentanimidamide?
The canonical SMILES for N'-hydroxy-3-phenoxypentanimidamide is CCC(C/C(N)=N/O)Oc1ccccc1.
What is the InChIKey of N'-hydroxy-3-phenoxypentanimidamide?
The InChIKey is FBYAISGTWKZDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-2-9(8-11(12)13-14)15-10-6-4-3-5-7-10/h3-7,9,14H,2,8H2,1H3,(H2,12,13).
What are the key properties of N'-hydroxy-3-phenoxypentanimidamide?
N'-hydroxy-3-phenoxypentanimidamide has a molecular weight of 208.26 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-3-phenoxypentanimidamide is sourced from PubChem (CID 43368248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).