N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide

C20H21NO4 — CID 4879965

IUPACN-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
SMILESCC=Cc1ccc(OCC(=O)Nc2cccc(C(C)=O)c2)c(OC)c1
InChIInChI=1S/C20H21NO4/c1-4-6-15-9-10-18(19(11-15)24-3)25-13-20(23)21-17-8-5-7-16(12-17)14(2)22/h4-12H,13H2,1-3H3,(H,21,23)
InChIKeyOSUCQYGWADKTDI-UHFFFAOYSA-N
MW339.39 g/mol
LogP3.95
Rot. Bonds7

About N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide

N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide (PubChem CID 4879965) has the molecular formula C20H21NO4 and a molecular weight of 339.39 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
PubChem CID4879965
Molecular FormulaC20H21NO4
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC NameN-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
SMILESCC=Cc1ccc(OCC(=O)Nc2cccc(C(C)=O)c2)c(OC)c1
InChIInChI=1S/C20H21NO4/c1-4-6-15-9-10-18(19(11-15)24-3)25-13-20(23)21-17-8-5-7-16(12-17)14(2)22/h4-12H,13H2,1-3H3,(H,21,23)
InChIKeyOSUCQYGWADKTDI-UHFFFAOYSA-N
XLogP3.95
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18279710
N-(3-hydroxy-4-methoxyphenyl)-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7478740
N-(3,5-dimethoxyphenyl)-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7772741
[2-(3-acetylanilino)-2-oxoethyl] 3-(3,4-dimethoxyphenyl)prop-2-enoate
CID 71823289
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-(4-sulfamoylphenyl)acetamide
CID 9314320
2-[4-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]phenyl]-2-methylpropanoic acid
CID 119253969
N-(3-methoxyphenyl)-2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]-methylamino]acetamide
CID 18170716
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-(2,4,6-trimethylphenyl)acetamide
CID 7695867
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 30034039
3-[4-[[2-(2-methoxy-4-prop-1-enylphenoxy)acetyl]amino]phenoxy]propanamide
CID 55727070
N-(5-chloro-2,4-dimethoxyphenyl)-2-[2-methoxy-4-[(Z)-prop-1-enyl]phenoxy]acetamide
CID 97426363
[2-(4-chloroanilino)-2-oxoethyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 7907929

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide (CID 4879965) is N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide is CC=Cc1ccc(OCC(=O)Nc2cccc(C(C)=O)c2)c(OC)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
The InChIKey is OSUCQYGWADKTDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO4/c1-4-6-15-9-10-18(19(11-15)24-3)25-13-20(23)21-17-8-5-7-16(12-17)14(2)22/h4-12H,13H2,1-3H3,(H,21,23).
What are the key properties of N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide has a molecular weight of 339.39 g/mol, XLogP of 3.95, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide is sourced from PubChem (CID 4879965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).