2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide

C20H24N2O3 — CID 54824256

IUPAC2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide
SMILESC=CCOc1ccccc1NCC(=O)Nc1cccc(OCCC)c1
InChIInChI=1S/C20H24N2O3/c1-3-12-24-17-9-7-8-16(14-17)22-20(23)15-21-18-10-5-6-11-19(18)25-13-4-2/h4-11,14,21H,2-3,12-13,15H2,1H3,(H,22,23)
InChIKeyUUOJGFYBWVZDFV-UHFFFAOYSA-N
MW340.42 g/mol
LogP4.09
Rot. Bonds10

About 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide

2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide (PubChem CID 54824256) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide
PubChem CID54824256
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide
SMILESC=CCOc1ccccc1NCC(=O)Nc1cccc(OCCC)c1
InChIInChI=1S/C20H24N2O3/c1-3-12-24-17-9-7-8-16(14-17)22-20(23)15-21-18-10-5-6-11-19(18)25-13-4-2/h4-11,14,21H,2-3,12-13,15H2,1H3,(H,22,23)
InChIKeyUUOJGFYBWVZDFV-UHFFFAOYSA-N
XLogP4.09
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-prop-2-enoxyphenyl)-2-(3-propoxyanilino)acetamide
CID 54824851
2-(4-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54821314
2-(3-hexoxyanilino)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54823386
N-[4-(2-phenoxyethoxy)phenyl]-2-(2-prop-2-enoxyanilino)acetamide
CID 54824592
2-(2-ethoxyanilino)-N-(3-ethoxyphenyl)acetamide
CID 54817200
3-[[2-(2-prop-2-enoxyanilino)acetyl]amino]-N-propylbenzamide
CID 54824294
3-[[2-(2-prop-2-enoxyanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54824667
2-[3-(2-phenylethoxy)anilino]-N-(2-prop-2-enoxyphenyl)acetamide
CID 54828312
N-(3-hexoxyphenyl)-2-(2-methoxyanilino)acetamide
CID 54817265
N-propan-2-yl-3-[[2-(2-prop-2-enoxyanilino)acetyl]amino]benzamide
CID 54824529
2-[4-(2-phenoxyethoxy)anilino]-N-(3-prop-2-enoxyphenyl)acetamide
CID 54822985
N-(2-methoxyethyl)-3-[[2-(2-prop-2-enoxyanilino)acetyl]amino]benzamide
CID 54824260

Frequently Asked Questions

What is the IUPAC name of 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide (CID 54824256) is 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide is C=CCOc1ccccc1NCC(=O)Nc1cccc(OCCC)c1.
What is the InChIKey of 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide?
The InChIKey is UUOJGFYBWVZDFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-3-12-24-17-9-7-8-16(14-17)22-20(23)15-21-18-10-5-6-11-19(18)25-13-4-2/h4-11,14,21H,2-3,12-13,15H2,1H3,(H,22,23).
What are the key properties of 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide?
2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide has a molecular weight of 340.42 g/mol, XLogP of 4.09, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-prop-2-enoxyanilino)-N-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 54824256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).