2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide

C15H23NO2 — CID 94124569

IUPAC2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
SMILESCCc1ccc(OCC(=O)N[C@H](C)C(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-5-13-6-8-14(9-7-13)18-10-15(17)16-12(4)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)/t12-/m1/s1
InChIKeyQUSWBHRYSVIZRP-GFCCVEGCSA-N
MW249.35 g/mol
LogP2.79
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide

2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide (PubChem CID 94124569) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
PubChem CID94124569
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
SMILESCCc1ccc(OCC(=O)N[C@H](C)C(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-5-13-6-8-14(9-7-13)18-10-15(17)16-12(4)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)/t12-/m1/s1
InChIKeyQUSWBHRYSVIZRP-GFCCVEGCSA-N
XLogP2.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(hydroxymethyl)phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 60623787
2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 99626723
N-[(2R)-3-methylbutan-2-yl]-2-[4-[4-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethoxy]phenyl]sulfanylphenoxy]acetamide
CID 40785701
2-[4-[(1R)-1-hydroxypropyl]phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 63365734
N-(3-methylbutan-2-yl)-2-(4-methylsulfanylphenoxy)acetamide
CID 134007912
2-[4-[(1R)-1-aminoethyl]phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 63367621
N-ethyl-2-[[2-(4-ethylphenoxy)acetyl]amino]propanamide
CID 47112875
2-[4-[(1R)-1-aminopropyl]phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 63367720
2-[[2-(4-ethylphenoxy)acetyl]amino]-3-methylpentanoic acid
CID 43239975
N-[1-(4-ethylphenyl)ethyl]-2-[4-(hydroxymethyl)phenoxy]acetamide
CID 110876929
N-[1-(4-ethylphenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 17326918
2-(4-bromophenoxy)-N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]acetamide
CID 7671319

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide (CID 94124569) is 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide is CCc1ccc(OCC(=O)N[C@H](C)C(C)C)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide?
The InChIKey is QUSWBHRYSVIZRP-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-13-6-8-14(9-7-13)18-10-15(17)16-12(4)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)/t12-/m1/s1.
What are the key properties of 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide?
2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide has a molecular weight of 249.35 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide is sourced from PubChem (CID 94124569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).