N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide

C13H17NO2 — CID 169465357

IUPACN-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide
SMILESCCOc1ccccc1C=CCNC(C)=O
InChIInChI=1S/C13H17NO2/c1-3-16-13-9-5-4-7-12(13)8-6-10-14-11(2)15/h4-9H,3,10H2,1-2H3,(H,14,15)
InChIKeyNWIUAUPVGFXSLA-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.23
Rot. Bonds5

About N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide

N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide (PubChem CID 169465357) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide
PubChem CID169465357
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide
SMILESCCOc1ccccc1C=CCNC(C)=O
InChIInChI=1S/C13H17NO2/c1-3-16-13-9-5-4-7-12(13)8-6-10-14-11(2)15/h4-9H,3,10H2,1-2H3,(H,14,15)
InChIKeyNWIUAUPVGFXSLA-UHFFFAOYSA-N
XLogP2.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(2-methoxyphenyl)prop-2-enyl]acetamide
CID 169465048
N-[3-[2-(2-hydrazinyl-2-oxoethoxy)phenyl]prop-2-enyl]acetamide
CID 169466327
3-(2-ethoxyphenyl)-N-ethylprop-2-enamide
CID 76872072
N-(3-naphthalen-1-ylprop-2-enyl)acetamide
CID 169465612
N-[3-(3-ethoxy-4-phenylmethoxyphenyl)prop-2-enyl]acetamide
CID 169466602
tert-butyl N-[3-(3-ethoxy-2-hydroxyphenyl)prop-2-enyl]carbamate
CID 169468789
1-(4-chlorobut-1-enyl)-2-ethoxybenzene
CID 79602930
N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide
CID 169464992
N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide
CID 169464873
N-[4-(2-methoxyphenyl)but-3-enyl]acetamide
CID 170488272
methyl 2-[2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]prop-1-enyl]phenoxy]acetate
CID 169468759
4-(2-ethoxyphenyl)but-3-en-1-amine
CID 76997332

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide?
The IUPAC name of N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide (CID 169465357) is N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide.
What is the SMILES notation for N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide?
The canonical SMILES for N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide is CCOc1ccccc1C=CCNC(C)=O.
What is the InChIKey of N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide?
The InChIKey is NWIUAUPVGFXSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-3-16-13-9-5-4-7-12(13)8-6-10-14-11(2)15/h4-9H,3,10H2,1-2H3,(H,14,15).
What are the key properties of N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide?
N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide has a molecular weight of 219.28 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide is sourced from PubChem (CID 169465357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).