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

C14H19NO2 — CID 60659508

IUPAC3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)CCc1ccccc1OCC
InChIInChI=1S/C14H19NO2/c1-3-11-15-14(16)10-9-12-7-5-6-8-13(12)17-4-2/h3,5-8H,1,4,9-11H2,2H3,(H,15,16)
InChIKeyVXWOAYSSQBOJBF-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.32
Rot. Bonds7

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

3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide (PubChem CID 60659508) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide
PubChem CID60659508
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)CCc1ccccc1OCC
InChIInChI=1S/C14H19NO2/c1-3-11-15-14(16)10-9-12-7-5-6-8-13(12)17-4-2/h3,5-8H,1,4,9-11H2,2H3,(H,15,16)
InChIKeyVXWOAYSSQBOJBF-UHFFFAOYSA-N
XLogP2.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[3-(2-ethoxyphenyl)propanoylamino]propanoic acid
CID 43170647
methyl 2-[3-(2-ethoxyphenyl)propanoylamino]acetate
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3-(2-ethoxyphenyl)-N-pentylpropanamide
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4-amino-N-[2-(2-ethoxyphenyl)ethyl]butanamide;hydrochloride
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N-[(5-bromothiophen-2-yl)methyl]-3-(2-ethoxyphenyl)propanamide
CID 32776552
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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide?
The IUPAC name of 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide (CID 60659508) is 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide.
What is the SMILES notation for 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide?
The canonical SMILES for 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide is C=CCNC(=O)CCc1ccccc1OCC.
What is the InChIKey of 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide?
The InChIKey is VXWOAYSSQBOJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-3-11-15-14(16)10-9-12-7-5-6-8-13(12)17-4-2/h3,5-8H,1,4,9-11H2,2H3,(H,15,16).
What are the key properties of 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide?
3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide has a molecular weight of 233.31 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenyl)-N-prop-2-enylpropanamide is sourced from PubChem (CID 60659508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).