(2S)-2-amino-5-phenylpentanoic acid

C11H15NO2 — CID 2761813

IUPAC(2S)-2-amino-5-phenylpentanoic acid
SMILESN[C@@H](CCCc1ccccc1)C(=O)O
InChIInChI=1S/C11H15NO2/c12-10(11(13)14)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8,12H2,(H,13,14)/t10-/m0/s1
InChIKeyXOQZTHUXZWQXOK-JTQLQIEISA-N
MW193.25 g/mol
LogP1.42
Rot. Bonds5

About (2S)-2-amino-5-phenylpentanoic acid

(2S)-2-amino-5-phenylpentanoic acid (PubChem CID 2761813) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is (2S)-2-amino-5-phenylpentanoic acid.

Molecular Properties

Compound Name(2S)-2-amino-5-phenylpentanoic acid
PubChem CID2761813
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name(2S)-2-amino-5-phenylpentanoic acid
SMILESN[C@@H](CCCc1ccccc1)C(=O)O
InChIInChI=1S/C11H15NO2/c12-10(11(13)14)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8,12H2,(H,13,14)/t10-/m0/s1
InChIKeyXOQZTHUXZWQXOK-JTQLQIEISA-N
XLogP1.42
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-5-phenylpentanoic acid?
The IUPAC name of (2S)-2-amino-5-phenylpentanoic acid (CID 2761813) is (2S)-2-amino-5-phenylpentanoic acid.
What is the SMILES notation for (2S)-2-amino-5-phenylpentanoic acid?
The canonical SMILES for (2S)-2-amino-5-phenylpentanoic acid is N[C@@H](CCCc1ccccc1)C(=O)O.
What is the InChIKey of (2S)-2-amino-5-phenylpentanoic acid?
The InChIKey is XOQZTHUXZWQXOK-JTQLQIEISA-N. The full InChI is InChI=1S/C11H15NO2/c12-10(11(13)14)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8,12H2,(H,13,14)/t10-/m0/s1.
What are the key properties of (2S)-2-amino-5-phenylpentanoic acid?
(2S)-2-amino-5-phenylpentanoic acid has a molecular weight of 193.25 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-5-phenylpentanoic acid is sourced from PubChem (CID 2761813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).