2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid

C15H23NO2 — CID 65061275

IUPAC2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid
SMILESCC(C)C(c1ccccc1)N(C)C(C)(C)C(=O)O
InChIInChI=1S/C15H23NO2/c1-11(2)13(12-9-7-6-8-10-12)16(5)15(3,4)14(17)18/h6-11,13H,1-5H3,(H,17,18)
InChIKeyOGEHVBLMYOMXHX-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.18
Rot. Bonds5

About 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid

2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid (PubChem CID 65061275) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid.

Molecular Properties

Compound Name2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid
PubChem CID65061275
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid
SMILESCC(C)C(c1ccccc1)N(C)C(C)(C)C(=O)O
InChIInChI=1S/C15H23NO2/c1-11(2)13(12-9-7-6-8-10-12)16(5)15(3,4)14(17)18/h6-11,13H,1-5H3,(H,17,18)
InChIKeyOGEHVBLMYOMXHX-UHFFFAOYSA-N
XLogP3.18
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propan-1-ol
CID 20583634
N-tert-butyl-N-(2-methyl-1-phenylpropyl)acetamide
CID 58983683
N-tert-butyl-N-(2-methyl-1-phenylpropyl)hydroxylamine;methane
CID 158212954
CID 132607463
CID 132607463
2-[1-(2-methoxyphenyl)ethyl-methylamino]-2-methylpropanoic acid
CID 65060788
4-[(1R)-1-(dimethylamino)-2-methylpropyl]benzoic acid
CID 118928762
2-[bis(2-hydroxy-2-phenylethyl)amino]-2-methylpropanoic acid
CID 22902564
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-phenylpropanamide
CID 114028856
2-[[(2S)-2-amino-2-phenylacetyl]-ethylamino]-2-methylpropanoic acid
CID 104897827
3-(4-hydroxy-2,2-dimethylpentyl)-1-methyl-1-(2-methyl-1-phenylpropyl)urea
CID 111507458
(2-fluoro-1-phenylpropyl)-methylcarbamic acid
CID 57373616
3-[methoxy-(2-methyl-1-phenylpropyl)amino]-3-methylbutanoate
CID 140706005

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid?
The IUPAC name of 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid (CID 65061275) is 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid.
What is the SMILES notation for 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid?
The canonical SMILES for 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid is CC(C)C(c1ccccc1)N(C)C(C)(C)C(=O)O.
What is the InChIKey of 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid?
The InChIKey is OGEHVBLMYOMXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(2)13(12-9-7-6-8-10-12)16(5)15(3,4)14(17)18/h6-11,13H,1-5H3,(H,17,18).
What are the key properties of 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid?
2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid has a molecular weight of 249.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[methyl-(2-methyl-1-phenylpropyl)amino]propanoic acid is sourced from PubChem (CID 65061275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).