2-(4-ethoxyphenoxy)butanamide

C12H17NO3 — CID 62901060

IUPAC2-(4-ethoxyphenoxy)butanamide
SMILESCCOc1ccc(OC(CC)C(N)=O)cc1
InChIInChI=1S/C12H17NO3/c1-3-11(12(13)14)16-10-7-5-9(6-8-10)15-4-2/h5-8,11H,3-4H2,1-2H3,(H2,13,14)
InChIKeyPXUHRUAPBNVOMT-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.73
Rot. Bonds6

About 2-(4-ethoxyphenoxy)butanamide

2-(4-ethoxyphenoxy)butanamide (PubChem CID 62901060) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 2-(4-ethoxyphenoxy)butanamide.

Molecular Properties

Compound Name2-(4-ethoxyphenoxy)butanamide
PubChem CID62901060
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name2-(4-ethoxyphenoxy)butanamide
SMILESCCOc1ccc(OC(CC)C(N)=O)cc1
InChIInChI=1S/C12H17NO3/c1-3-11(12(13)14)16-10-7-5-9(6-8-10)15-4-2/h5-8,11H,3-4H2,1-2H3,(H2,13,14)
InChIKeyPXUHRUAPBNVOMT-UHFFFAOYSA-N
XLogP1.73
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenoxy)butanamide
CID 4980758
4-(1-amino-1-oxobutan-2-yl)oxybenzenesulfonyl chloride
CID 82916384
2-[4-(methylaminomethyl)phenoxy]butanamide
CID 62900383
2-(4-ethoxyphenoxy)-1-phenylbutan-1-one
CID 43799769
ethyl 2-(4-methylphenoxy)butanoate
CID 64662052
2-(3-aminophenoxy)butanamide
CID 62901524
(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide
CID 42082583
2-(1,3-benzodioxol-5-yloxy)butanamide
CID 62901253
N-[(4-ethoxyphenyl)methyl]-2-(4-ethylphenoxy)butanamide
CID 53288894
4-(1-amino-1-oxobutan-2-yl)oxy-2-fluorobenzoic acid
CID 107675391
6-amino-2-(4-ethoxyphenoxy)hexanoic acid
CID 112745829
2-(4-ethoxyphenyl)-3-hydroxybutanamide
CID 152610342

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenoxy)butanamide?
The IUPAC name of 2-(4-ethoxyphenoxy)butanamide (CID 62901060) is 2-(4-ethoxyphenoxy)butanamide.
What is the SMILES notation for 2-(4-ethoxyphenoxy)butanamide?
The canonical SMILES for 2-(4-ethoxyphenoxy)butanamide is CCOc1ccc(OC(CC)C(N)=O)cc1.
What is the InChIKey of 2-(4-ethoxyphenoxy)butanamide?
The InChIKey is PXUHRUAPBNVOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-3-11(12(13)14)16-10-7-5-9(6-8-10)15-4-2/h5-8,11H,3-4H2,1-2H3,(H2,13,14).
What are the key properties of 2-(4-ethoxyphenoxy)butanamide?
2-(4-ethoxyphenoxy)butanamide has a molecular weight of 223.27 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenoxy)butanamide is sourced from PubChem (CID 62901060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).