N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide

C19H23NO4 — CID 42958085

IUPACN-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide
SMILESCCc1ccc(OCC(O)COc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23NO4/c1-3-15-4-8-18(9-5-15)23-12-17(22)13-24-19-10-6-16(7-11-19)20-14(2)21/h4-11,17,22H,3,12-13H2,1-2H3,(H,20,21)
InChIKeyAUXWKUJPKGNYGU-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.03
Rot. Bonds8

About N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide

N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide (PubChem CID 42958085) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide
PubChem CID42958085
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC NameN-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide
SMILESCCc1ccc(OCC(O)COc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23NO4/c1-3-15-4-8-18(9-5-15)23-12-17(22)13-24-19-10-6-16(7-11-19)20-14(2)21/h4-11,17,22H,3,12-13H2,1-2H3,(H,20,21)
InChIKeyAUXWKUJPKGNYGU-UHFFFAOYSA-N
XLogP3.03
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide
CID 4883
(2S)-2-(4-ethylphenoxy)-N-[4-(2-methylpropoxy)phenyl]propanamide
CID 9237321
N-(4-acetamidophenyl)-2-(4-ethylphenoxy)propanamide
CID 4953258
[(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] 2-(4-ethylphenoxy)acetate
CID 7844674
N-[4-(2-hydroxy-3,3-dimethylbutoxy)phenyl]acetamide
CID 114265317
1-(4-ethylphenoxy)-3-(methylamino)propan-2-ol
CID 43188012
N-[4-[(2R)-3-(2,5-dichlorophenoxy)-2-hydroxypropoxy]phenyl]acetamide
CID 51725545
N-[4-[(2S)-3-(2,5-dichlorophenoxy)-2-hydroxypropoxy]phenyl]acetamide
CID 51725544
(2S)-1-(tert-butylamino)-3-(4-ethylphenoxy)propan-2-ol
CID 787574
(2R)-1-(tert-butylamino)-3-(4-ethylphenoxy)propan-2-ol
CID 787572
[(2S)-3-(4-ethylphenoxy)-2-hydroxypropyl]-trimethylazanium
CID 6940355
N-[4-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)phenyl]acetamide chloride
CID 46863837

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide?
The IUPAC name of N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide (CID 42958085) is N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide is CCc1ccc(OCC(O)COc2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide?
The InChIKey is AUXWKUJPKGNYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-3-15-4-8-18(9-5-15)23-12-17(22)13-24-19-10-6-16(7-11-19)20-14(2)21/h4-11,17,22H,3,12-13H2,1-2H3,(H,20,21).
What are the key properties of N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide?
N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide has a molecular weight of 329.40 g/mol, XLogP of 3.03, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(4-ethylphenoxy)-2-hydroxypropoxy]phenyl]acetamide is sourced from PubChem (CID 42958085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).