(2S)-N-ethyl-2-hydroxy-3-phenylpropanamide

C11H15NO2 — CID 13215109

IUPAC(2S)-N-ethyl-2-hydroxy-3-phenylpropanamide
SMILESCCNC(=O)[C@@H](O)Cc1ccccc1
InChIInChI=1S/C11H15NO2/c1-2-12-11(14)10(13)8-9-6-4-3-5-7-9/h3-7,10,13H,2,8H2,1H3,(H,12,14)/t10-/m0/s1
InChIKeyKRHIPYMMRCZUMF-JTQLQIEISA-N
MW193.25 g/mol
LogP0.73
Rot. Bonds4

About (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide

(2S)-N-ethyl-2-hydroxy-3-phenylpropanamide (PubChem CID 13215109) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide.

Molecular Properties

Compound Name(2S)-N-ethyl-2-hydroxy-3-phenylpropanamide
PubChem CID13215109
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name(2S)-N-ethyl-2-hydroxy-3-phenylpropanamide
SMILESCCNC(=O)[C@@H](O)Cc1ccccc1
InChIInChI=1S/C11H15NO2/c1-2-12-11(14)10(13)8-9-6-4-3-5-7-9/h3-7,10,13H,2,8H2,1H3,(H,12,14)/t10-/m0/s1
InChIKeyKRHIPYMMRCZUMF-JTQLQIEISA-N
XLogP0.73
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide?
The IUPAC name of (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide (CID 13215109) is (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide.
What is the SMILES notation for (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide?
The canonical SMILES for (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide is CCNC(=O)[C@@H](O)Cc1ccccc1.
What is the InChIKey of (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide?
The InChIKey is KRHIPYMMRCZUMF-JTQLQIEISA-N. The full InChI is InChI=1S/C11H15NO2/c1-2-12-11(14)10(13)8-9-6-4-3-5-7-9/h3-7,10,13H,2,8H2,1H3,(H,12,14)/t10-/m0/s1.
What are the key properties of (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide?
(2S)-N-ethyl-2-hydroxy-3-phenylpropanamide has a molecular weight of 193.25 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-ethyl-2-hydroxy-3-phenylpropanamide is sourced from PubChem (CID 13215109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).