(2S)-2-amino-5,5,5-triphenylpentanoic acid

C23H23NO2 — CID 57325587

IUPAC(2S)-2-amino-5,5,5-triphenylpentanoic acid
SMILESN[C@@H](CCC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O
InChIInChI=1S/C23H23NO2/c24-21(22(25)26)16-17-23(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17,24H2,(H,25,26)/t21-/m0/s1
InChIKeyFZRDGJPHAFKQNC-NRFANRHFSA-N
MW345.44 g/mol
LogP4.21
Rot. Bonds7

About (2S)-2-amino-5,5,5-triphenylpentanoic acid

(2S)-2-amino-5,5,5-triphenylpentanoic acid (PubChem CID 57325587) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is (2S)-2-amino-5,5,5-triphenylpentanoic acid.

Molecular Properties

Compound Name(2S)-2-amino-5,5,5-triphenylpentanoic acid
PubChem CID57325587
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC Name(2S)-2-amino-5,5,5-triphenylpentanoic acid
SMILESN[C@@H](CCC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O
InChIInChI=1S/C23H23NO2/c24-21(22(25)26)16-17-23(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17,24H2,(H,25,26)/t21-/m0/s1
InChIKeyFZRDGJPHAFKQNC-NRFANRHFSA-N
XLogP4.21
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-5,5,5-triphenylpentanoic acid?
The IUPAC name of (2S)-2-amino-5,5,5-triphenylpentanoic acid (CID 57325587) is (2S)-2-amino-5,5,5-triphenylpentanoic acid.
What is the SMILES notation for (2S)-2-amino-5,5,5-triphenylpentanoic acid?
The canonical SMILES for (2S)-2-amino-5,5,5-triphenylpentanoic acid is N[C@@H](CCC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O.
What is the InChIKey of (2S)-2-amino-5,5,5-triphenylpentanoic acid?
The InChIKey is FZRDGJPHAFKQNC-NRFANRHFSA-N. The full InChI is InChI=1S/C23H23NO2/c24-21(22(25)26)16-17-23(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17,24H2,(H,25,26)/t21-/m0/s1.
What are the key properties of (2S)-2-amino-5,5,5-triphenylpentanoic acid?
(2S)-2-amino-5,5,5-triphenylpentanoic acid has a molecular weight of 345.44 g/mol, XLogP of 4.21, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-5,5,5-triphenylpentanoic acid is sourced from PubChem (CID 57325587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).