(2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide

C15H23NO2 — CID 94033716

IUPAC(2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide
SMILESCCNC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-6-16-14(17)11(2)18-13-9-7-12(8-10-13)15(3,4)5/h7-11H,6H2,1-5H3,(H,16,17)/t11-/m1/s1
InChIKeyYCCQLILCCFVQGB-LLVKDONJSA-N
MW249.35 g/mol
LogP2.89
Rot. Bonds4

About (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide

(2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide (PubChem CID 94033716) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide.

Molecular Properties

Compound Name(2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide
PubChem CID94033716
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide
SMILESCCNC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-6-16-14(17)11(2)18-13-9-7-12(8-10-13)15(3,4)5/h7-11H,6H2,1-5H3,(H,16,17)/t11-/m1/s1
InChIKeyYCCQLILCCFVQGB-LLVKDONJSA-N
XLogP2.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-tert-butylphenoxy)-N-(2-methylpropyl)propanamide
CID 19204146
N-ethyl-2-phenoxypropanamide
CID 4282518
N-(3-amino-2-methylpropyl)-2-(4-tert-butylphenoxy)propanamide
CID 119997217
2-(4-tert-butylphenoxy)-N-propan-2-ylpropanamide
CID 16620513
2-(4-tert-butylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 2960859
2-(4-tert-butylphenoxy)-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
CID 46422027
(2S)-2-(4-tert-butylphenoxy)-N-[(2-fluorophenyl)methyl]propanamide
CID 8571270
2-[2-[2-(4-tert-butylphenoxy)propanoylamino]ethylsulfanyl]acetic acid
CID 119241322
(2R)-2-(4-tert-butylphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 973402
N-ethyl-2-(4-nitrophenoxy)propanamide
CID 4951333
(2S)-2-(4-tert-butylphenoxy)-N-(4-ethylphenyl)propanamide
CID 7703328
2-(4-tert-butylphenoxy)-N-[3-[ethyl(methylsulfonyl)amino]propyl]propanamide
CID 60552437

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide?
The IUPAC name of (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide (CID 94033716) is (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide.
What is the SMILES notation for (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide?
The canonical SMILES for (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide is CCNC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1.
What is the InChIKey of (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide?
The InChIKey is YCCQLILCCFVQGB-LLVKDONJSA-N. The full InChI is InChI=1S/C15H23NO2/c1-6-16-14(17)11(2)18-13-9-7-12(8-10-13)15(3,4)5/h7-11H,6H2,1-5H3,(H,16,17)/t11-/m1/s1.
What are the key properties of (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide?
(2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide has a molecular weight of 249.35 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-tert-butylphenoxy)-N-ethylpropanamide is sourced from PubChem (CID 94033716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).