2-(4-ethoxyphenyl)-3-hydroxybutanamide

C12H17NO3 — CID 152610342

IUPAC2-(4-ethoxyphenyl)-3-hydroxybutanamide
SMILESCCOc1ccc(C(C(N)=O)C(C)O)cc1
InChIInChI=1S/C12H17NO3/c1-3-16-10-6-4-9(5-7-10)11(8(2)14)12(13)15/h4-8,11,14H,3H2,1-2H3,(H2,13,15)
InChIKeyYZJMSSRDBYXZRB-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.03
Rot. Bonds5

About 2-(4-ethoxyphenyl)-3-hydroxybutanamide

2-(4-ethoxyphenyl)-3-hydroxybutanamide (PubChem CID 152610342) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-3-hydroxybutanamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-3-hydroxybutanamide
PubChem CID152610342
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name2-(4-ethoxyphenyl)-3-hydroxybutanamide
SMILESCCOc1ccc(C(C(N)=O)C(C)O)cc1
InChIInChI=1S/C12H17NO3/c1-3-16-10-6-4-9(5-7-10)11(8(2)14)12(13)15/h4-8,11,14H,3H2,1-2H3,(H2,13,15)
InChIKeyYZJMSSRDBYXZRB-UHFFFAOYSA-N
XLogP1.03
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(4-ethoxyphenyl)ethylamino]propanamide
CID 43402762
(1S,2R)-1-amino-1-(4-ethoxyphenyl)propan-2-ol;hydrochloride
CID 171266991
ethyl 2-(4-ethoxyphenyl)propanoate
CID 105479148
3-(4-ethoxyphenyl)-4-methylpentanamide
CID 112508295
2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide
CID 54891036
methyl 2-(4-ethoxyphenyl)-2-hydroxyacetate
CID 62214123
methyl 2-(4-ethoxyphenyl)propanoate
CID 62394502
amino-(4-ethoxyphenyl)methanol
CID 116939610
2-(4-ethoxyphenoxy)butanamide
CID 62901060
(2S)-2-amino-2-(4-ethoxyphenyl)acetic acid;hydrochloride
CID 162344172
3-[4-[(1R)-1-hydroxyethyl]phenoxy]-2-methylpropanamide
CID 63364284
2-[2-amino-2-(4-ethoxyphenyl)ethoxy]acetamide
CID 61327412

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-3-hydroxybutanamide?
The IUPAC name of 2-(4-ethoxyphenyl)-3-hydroxybutanamide (CID 152610342) is 2-(4-ethoxyphenyl)-3-hydroxybutanamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-3-hydroxybutanamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-3-hydroxybutanamide is CCOc1ccc(C(C(N)=O)C(C)O)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-3-hydroxybutanamide?
The InChIKey is YZJMSSRDBYXZRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-3-16-10-6-4-9(5-7-10)11(8(2)14)12(13)15/h4-8,11,14H,3H2,1-2H3,(H2,13,15).
What are the key properties of 2-(4-ethoxyphenyl)-3-hydroxybutanamide?
2-(4-ethoxyphenyl)-3-hydroxybutanamide has a molecular weight of 223.27 g/mol, XLogP of 1.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-3-hydroxybutanamide is sourced from PubChem (CID 152610342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).