2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid

C11H20N2O3 — CID 62820953

IUPAC2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid
SMILESCC1CCN(C(=O)N(C)C(C)(C)C(=O)O)C1
InChIInChI=1S/C11H20N2O3/c1-8-5-6-13(7-8)10(16)12(4)11(2,3)9(14)15/h8H,5-7H2,1-4H3,(H,14,15)
InChIKeyWBDOLCKNCOFVLQ-UHFFFAOYSA-N
MW228.29 g/mol
LogP1.24
Rot. Bonds2

About 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid

2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid (PubChem CID 62820953) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid.

Molecular Properties

Compound Name2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid
PubChem CID62820953
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid
SMILESCC1CCN(C(=O)N(C)C(C)(C)C(=O)O)C1
InChIInChI=1S/C11H20N2O3/c1-8-5-6-13(7-8)10(16)12(4)11(2,3)9(14)15/h8H,5-7H2,1-4H3,(H,14,15)
InChIKeyWBDOLCKNCOFVLQ-UHFFFAOYSA-N
XLogP1.24
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)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-[1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carbonyl(methyl)amino]-2-methylpropanoic acid
CID 79934656
2-[[2-(hydroxymethyl)morpholine-4-carbonyl]-methylamino]-2-methylpropanoic acid
CID 81204121
N-cyclopropyl-N,3-dimethylpyrrolidine-1-carboxamide
CID 131154116
2-[(4-ethoxycarbonylpiperazine-1-carbonyl)-methylamino]-2-methylpropanoic acid
CID 107877501
2,2-dimethyl-3-(4-methylpiperidin-1-yl)-3-oxopropanoic acid
CID 82813575
2,2-difluoro-1-(3-methylpyrrolidin-1-yl)propan-1-one
CID 130667579
2-[cyclopropanecarbonyl(methyl)amino]-2-methylpropanoic acid
CID 62817910
azetidin-1-yl-(3-methylpyrrolidin-1-yl)methanone
CID 166738845
ethane;2-fluoro-2-methyl-1-(3-methylpyrrolidin-1-yl)propan-1-one
CID 177053865
tert-butyl (3R)-3-methylpyrrolidine-1-carboxylate
CID 59070240
2-methyl-3-(3-methylpyrrolidin-1-yl)-3-oxopropanoic acid
CID 114898189
2-[2-methylpropyl-(3-methylpyrrolidine-1-carbonyl)amino]acetic acid
CID 63064206

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid?
The IUPAC name of 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid (CID 62820953) is 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid.
What is the SMILES notation for 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid?
The canonical SMILES for 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid is CC1CCN(C(=O)N(C)C(C)(C)C(=O)O)C1.
What is the InChIKey of 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid?
The InChIKey is WBDOLCKNCOFVLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-8-5-6-13(7-8)10(16)12(4)11(2,3)9(14)15/h8H,5-7H2,1-4H3,(H,14,15).
What are the key properties of 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid?
2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid has a molecular weight of 228.29 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[methyl-(3-methylpyrrolidine-1-carbonyl)amino]propanoic acid is sourced from PubChem (CID 62820953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).