phenol;N-phenoxyacetamide

C14H15NO3 — CID 174815044

IUPACphenol;N-phenoxyacetamide
SMILESCC(=O)NOc1ccccc1.Oc1ccccc1
InChIInChI=1S/C8H9NO2.C6H6O/c1-7(10)9-11-8-5-3-2-4-6-8;7-6-4-2-1-3-5-6/h2-6H,1H3,(H,9,10);1-5,7H
InChIKeyKBKOPBUKJVZLFA-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.51
Rot. Bonds2

About phenol;N-phenoxyacetamide

phenol;N-phenoxyacetamide (PubChem CID 174815044) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is phenol;N-phenoxyacetamide.

Molecular Properties

Compound Namephenol;N-phenoxyacetamide
PubChem CID174815044
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Namephenol;N-phenoxyacetamide
SMILESCC(=O)NOc1ccccc1.Oc1ccccc1
InChIInChI=1S/C8H9NO2.C6H6O/c1-7(10)9-11-8-5-3-2-4-6-8;7-6-4-2-1-3-5-6/h2-6H,1H3,(H,9,10);1-5,7H
InChIKeyKBKOPBUKJVZLFA-UHFFFAOYSA-N
XLogP2.51
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

acetic acid;N-phenoxyacetamide;O-phenylhydroxylamine
CID 160787264
acetic acid;phenol
CID 70537927
benzene;ethane;methyl acetate;phenol
CID 162170522
methyl hydrogen carbonate;phenol
CID 126664263
dimethyl carbonate;methanol;methyl phenyl carbonate;phenol
CID 158199044
N-(3-methylphenoxy)acetamide
CID 102440503
phenol;propan-2-one;hydrate
CID 161159865
2,2-dimethyl-N-phenoxypropanamide
CID 20584483
phenol;phenyl hydrogen carbonate
CID 23470013
(phenoxyamino)urea
CID 67928510
CID 67496590
CID 67496590
N-(4-cyanophenoxy)acetamide
CID 174609340

Frequently Asked Questions

What is the IUPAC name of phenol;N-phenoxyacetamide?
The IUPAC name of phenol;N-phenoxyacetamide (CID 174815044) is phenol;N-phenoxyacetamide.
What is the SMILES notation for phenol;N-phenoxyacetamide?
The canonical SMILES for phenol;N-phenoxyacetamide is CC(=O)NOc1ccccc1.Oc1ccccc1.
What is the InChIKey of phenol;N-phenoxyacetamide?
The InChIKey is KBKOPBUKJVZLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2.C6H6O/c1-7(10)9-11-8-5-3-2-4-6-8;7-6-4-2-1-3-5-6/h2-6H,1H3,(H,9,10);1-5,7H.
What are the key properties of phenol;N-phenoxyacetamide?
phenol;N-phenoxyacetamide has a molecular weight of 245.28 g/mol, XLogP of 2.51, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenol;N-phenoxyacetamide is sourced from PubChem (CID 174815044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).