3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide

C13H17NO3 — CID 17034572

IUPAC3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)CCOc1ccccc1OC
InChIInChI=1S/C13H17NO3/c1-3-9-14-13(15)8-10-17-12-7-5-4-6-11(12)16-2/h3-7H,1,8-10H2,2H3,(H,14,15)
InChIKeyNPSUTAJZZUNUEM-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.77
Rot. Bonds7

About 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide

3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide (PubChem CID 17034572) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide
PubChem CID17034572
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)CCOc1ccccc1OC
InChIInChI=1S/C13H17NO3/c1-3-9-14-13(15)8-10-17-12-7-5-4-6-11(12)16-2/h3-7H,1,8-10H2,2H3,(H,14,15)
InChIKeyNPSUTAJZZUNUEM-UHFFFAOYSA-N
XLogP1.77
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.77
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

N-[(4-fluorophenyl)methyl]-3-(2-methoxyphenoxy)propanamide
CID 4789934
N-[2-oxo-2-(prop-2-enylamino)ethyl]-3-phenoxypropanamide
CID 112990545
N-(4-anilinophenyl)-3-(2-methoxyphenoxy)propanamide
CID 60520385
N-[4-(2-methoxyphenoxy)but-2-ynyl]pent-4-enamide
CID 71802876
2-methoxy-N-prop-2-enylbenzamide
CID 4063222
4-(2-methoxyphenoxy)butanehydrazide
CID 63576005
2,6-dimethoxy-N-prop-2-enylbenzamide
CID 3569670
N-[2-(2-methoxyphenoxy)ethyl]octadecanamide
CID 5113156
3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide
CID 60659508
3-(2-methoxyphenoxy)propanoyl chloride
CID 82040752
N-[2-(4-aminophenyl)ethyl]-3-(2-methoxyphenoxy)propanamide;hydrochloride
CID 119548049
3-(2-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]propanamide
CID 134056529

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide?
The IUPAC name of 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide (CID 17034572) is 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide.
What is the SMILES notation for 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide?
The canonical SMILES for 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide is C=CCNC(=O)CCOc1ccccc1OC.
What is the InChIKey of 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide?
The InChIKey is NPSUTAJZZUNUEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-3-9-14-13(15)8-10-17-12-7-5-4-6-11(12)16-2/h3-7H,1,8-10H2,2H3,(H,14,15).
What are the key properties of 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide?
3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide has a molecular weight of 235.28 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenoxy)-N-prop-2-enylpropanamide is sourced from PubChem (CID 17034572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).