N-phenoxyacetamide

C8H9NO2 — CID 537524

IUPACN-phenoxyacetamide
SMILESCC(=O)NOc1ccccc1
InChIInChI=1S/C8H9NO2/c1-7(10)9-11-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)
InChIKeyQCPORYSHAZPBCG-UHFFFAOYSA-N
MW151.16 g/mol
LogP1.12
Rot. Bonds2

About N-phenoxyacetamide

N-phenoxyacetamide (PubChem CID 537524) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is N-phenoxyacetamide.

Molecular Properties

Compound NameN-phenoxyacetamide
PubChem CID537524
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC NameN-phenoxyacetamide
SMILESCC(=O)NOc1ccccc1
InChIInChI=1S/C8H9NO2/c1-7(10)9-11-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)
InChIKeyQCPORYSHAZPBCG-UHFFFAOYSA-N
XLogP1.12
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-fluorophenoxy)acetamide
CID 71726189
N-[4-(trifluoromethyl)phenoxy]acetamide
CID 162546353
Phenoxy-ethyl amine
CID 12617693
N-(3,5-difluorophenoxy)acetamide
CID 125475494
N-[3-(trifluoromethyl)phenoxy]acetamide
CID 176435775
N-(4-methylphenoxy)acetamide
CID 10654597
N-(4-bromophenoxy)acetamide
CID 12129384
Phenoxyaminopropane
CID 19907819
N-phenoxypivalamide
CID 20584483
Phenoxyisocyanate
CID 21967051
N-phenoxyformamide
CID 22314519
N-(4-chlorophenoxy)acetamide
CID 23180479

Frequently Asked Questions

What is the IUPAC name of N-phenoxyacetamide?
The IUPAC name of N-phenoxyacetamide (CID 537524) is N-phenoxyacetamide.
What is the SMILES notation for N-phenoxyacetamide?
The canonical SMILES for N-phenoxyacetamide is CC(=O)NOc1ccccc1.
What is the InChIKey of N-phenoxyacetamide?
The InChIKey is QCPORYSHAZPBCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-7(10)9-11-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10).
What are the key properties of N-phenoxyacetamide?
N-phenoxyacetamide has a molecular weight of 151.16 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenoxyacetamide is sourced from PubChem (CID 537524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).