2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide

C15H19NO4 — CID 78906259

IUPAC2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide
SMILESCOc1ccc(C(C)=O)c(OC(C)C(=O)NC2CC2)c1
InChIInChI=1S/C15H19NO4/c1-9(17)13-7-6-12(19-3)8-14(13)20-10(2)15(18)16-11-4-5-11/h6-8,10-11H,4-5H2,1-3H3,(H,16,18)
InChIKeyFPWMXYMDOBOTOD-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.94
Rot. Bonds6

About 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide

2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide (PubChem CID 78906259) has the molecular formula C15H19NO4 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide
PubChem CID78906259
Molecular FormulaC15H19NO4
Molecular Weight277.32 g/mol
Exact Mass277.13
IUPAC Name2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide
SMILESCOc1ccc(C(C)=O)c(OC(C)C(=O)NC2CC2)c1
InChIInChI=1S/C15H19NO4/c1-9(17)13-7-6-12(19-3)8-14(13)20-10(2)15(18)16-11-4-5-11/h6-8,10-11H,4-5H2,1-3H3,(H,16,18)
InChIKeyFPWMXYMDOBOTOD-UHFFFAOYSA-N
XLogP1.94
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(2-acetyl-5-methoxyphenoxy)-N-propan-2-ylpropanamide
CID 32886949
(2R)-N-cyclopropyl-2-(4-methoxyphenoxy)propanamide
CID 7865701
N-cyclopropyl-2-(2-formyl-4-methoxyphenoxy)propanamide
CID 43212710
2-(2-acetyl-5-methoxyphenoxy)-N-butan-2-ylpropanamide
CID 115279935
2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide
CID 61268519
2-(2-acetyl-5-methoxyphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 51233960
ethyl 2-(2-acetyl-5-methoxyphenoxy)propanoate
CID 15267098
[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2,5-dimethoxybenzoate
CID 7487392
2-(4-methoxyphenoxy)-N-(4-methylcyclohexyl)propanamide
CID 51326792
2-(2-acetylphenoxy)-N-cyclohexylpropanamide
CID 43083117
N-cyclopropyl-2,4-dimethoxybenzamide
CID 4576292
[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-fluoro-4-methoxybenzoate
CID 7887835

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide?
The IUPAC name of 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide (CID 78906259) is 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide.
What is the SMILES notation for 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide?
The canonical SMILES for 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide is COc1ccc(C(C)=O)c(OC(C)C(=O)NC2CC2)c1.
What is the InChIKey of 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide?
The InChIKey is FPWMXYMDOBOTOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO4/c1-9(17)13-7-6-12(19-3)8-14(13)20-10(2)15(18)16-11-4-5-11/h6-8,10-11H,4-5H2,1-3H3,(H,16,18).
What are the key properties of 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide?
2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide has a molecular weight of 277.32 g/mol, XLogP of 1.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide is sourced from PubChem (CID 78906259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).