2-methyl-2-(tritylamino)propanoic acid

C23H23NO2 — CID 71215938

IUPAC2-methyl-2-(tritylamino)propanoic acid
SMILESCC(C)(NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O
InChIInChI=1S/C23H23NO2/c1-22(2,21(25)26)24-23(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17,24H,1-2H3,(H,25,26)
InChIKeyVIIDFKVWPYDYCI-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.43
Rot. Bonds6

About 2-methyl-2-(tritylamino)propanoic acid

2-methyl-2-(tritylamino)propanoic acid (PubChem CID 71215938) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is 2-methyl-2-(tritylamino)propanoic acid.

Molecular Properties

Compound Name2-methyl-2-(tritylamino)propanoic acid
PubChem CID71215938
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC Name2-methyl-2-(tritylamino)propanoic acid
SMILESCC(C)(NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O
InChIInChI=1S/C23H23NO2/c1-22(2,21(25)26)24-23(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17,24H,1-2H3,(H,25,26)
InChIKeyVIIDFKVWPYDYCI-UHFFFAOYSA-N
XLogP4.43
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.43
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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Related Compounds

2-bromo-2-methyl-N-tritylpropanamide
CID 11475304
(2R)-2-hydroxy-2-phenylpropanoic acid
CID 736858
ethane;2-hydroxy-2,2-diphenylacetic acid
CID 143307418
2-methyl-2-[(3-methyl-3-phenylbutanoyl)amino]propanoic acid
CID 119187916
magnesium;hydride;2-methyl-2-phenylpropanoic acid
CID 174669783
1-methyl-3-tritylurea
CID 167052887
2-oxo-N-tritylpropanamide
CID 165388069
methyl 2-hydroxy-4,4-dimethyl-3-oxo-2-phenylpentanoate
CID 24976781
(2R)-2-acetamido-2-phenylpropanoic acid
CID 91535796
2-(benzhydrylamino)-2-methylpropanoic acid
CID 174216539
2-phenylpropan-2-ylcarbamic acid
CID 23445609
3-hydroxy-2,2-dimethyl-3-phenylbutanoic acid
CID 12570468

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(tritylamino)propanoic acid?
The IUPAC name of 2-methyl-2-(tritylamino)propanoic acid (CID 71215938) is 2-methyl-2-(tritylamino)propanoic acid.
What is the SMILES notation for 2-methyl-2-(tritylamino)propanoic acid?
The canonical SMILES for 2-methyl-2-(tritylamino)propanoic acid is CC(C)(NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O.
What is the InChIKey of 2-methyl-2-(tritylamino)propanoic acid?
The InChIKey is VIIDFKVWPYDYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-22(2,21(25)26)24-23(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17,24H,1-2H3,(H,25,26).
What are the key properties of 2-methyl-2-(tritylamino)propanoic acid?
2-methyl-2-(tritylamino)propanoic acid has a molecular weight of 345.44 g/mol, XLogP of 4.43, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(tritylamino)propanoic acid is sourced from PubChem (CID 71215938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).