2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide

C17H17NO3 — CID 2681751

IUPAC2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C17H17NO3/c1-2-11-18-17(19)13-20-15-9-6-10-16(12-15)21-14-7-4-3-5-8-14/h2-10,12H,1,11,13H2,(H,18,19)
InChIKeyRZKGUHGTDVHIGX-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.16
Rot. Bonds7

About 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide

2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide (PubChem CID 2681751) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide
PubChem CID2681751
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C17H17NO3/c1-2-11-18-17(19)13-20-15-9-6-10-16(12-15)21-14-7-4-3-5-8-14/h2-10,12H,1,11,13H2,(H,18,19)
InChIKeyRZKGUHGTDVHIGX-UHFFFAOYSA-N
XLogP3.16
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(3-methoxyphenoxy)-N-prop-2-enylacetamide
CID 19204009
2-(3-iodophenoxy)-N-prop-2-enylacetamide
CID 60626724
2-[(2-phenoxyacetyl)amino]-N-prop-2-enylacetamide
CID 2094904
2-(3-ethylphenoxy)-N-prop-2-enylacetamide
CID 19177242
2-(3-cyanophenoxy)-N-prop-2-enylacetamide
CID 24699881
2-[3-[(1S)-1-aminoethyl]phenoxy]-N-prop-2-enylacetamide
CID 55190627
2-[3-(ethylaminomethyl)phenoxy]-N-prop-2-enylacetamide
CID 60882038
2-phenoxy-N-[4-[3-[4-[(2-phenoxyacetyl)amino]phenoxy]phenoxy]phenyl]acetamide
CID 4227761
N-(4-methylphenyl)-2-(3-phenoxyphenoxy)acetamide
CID 23904816
N-[(4-methoxyphenyl)methyl]-2-(3-phenoxyphenoxy)acetamide
CID 2681736
2-(3-phenoxyphenoxy)acetate
CID 22411603
2-(3-aminophenoxy)-N-(prop-2-enylcarbamoyl)acetamide
CID 54908616

Frequently Asked Questions

What is the IUPAC name of 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide?
The IUPAC name of 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide (CID 2681751) is 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide is C=CCNC(=O)COc1cccc(Oc2ccccc2)c1.
What is the InChIKey of 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide?
The InChIKey is RZKGUHGTDVHIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-2-11-18-17(19)13-20-15-9-6-10-16(12-15)21-14-7-4-3-5-8-14/h2-10,12H,1,11,13H2,(H,18,19).
What are the key properties of 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide?
2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide has a molecular weight of 283.33 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-phenoxyphenoxy)-N-prop-2-enylacetamide is sourced from PubChem (CID 2681751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).