2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid

C10H21NO4 — CID 81056783

IUPAC2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
SMILESCC(C)OCCN(C)CC(C)(O)C(=O)O
InChIInChI=1S/C10H21NO4/c1-8(2)15-6-5-11(4)7-10(3,14)9(12)13/h8,14H,5-7H2,1-4H3,(H,12,13)
InChIKeyYZKCZLHESYFWTN-UHFFFAOYSA-N
MW219.28 g/mol
LogP0.18
Rot. Bonds7

About 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid

2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid (PubChem CID 81056783) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid.

Molecular Properties

Compound Name2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
PubChem CID81056783
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
SMILESCC(C)OCCN(C)CC(C)(O)C(=O)O
InChIInChI=1S/C10H21NO4/c1-8(2)15-6-5-11(4)7-10(3,14)9(12)13/h8,14H,5-7H2,1-4H3,(H,12,13)
InChIKeyYZKCZLHESYFWTN-UHFFFAOYSA-N
XLogP0.18
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
CID 81057064
1-N,2-dimethyl-1-N-(2-propan-2-yloxyethyl)propane-1,2-diamine
CID 81055039
3-[3-aminopropyl(methyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 104645222
ethane;2-[methyl(2-propan-2-yloxyethyl)amino]acetic acid
CID 156795596
2,2,2-trifluoro-N-methyl-N-(2-propan-2-yloxyethyl)ethanamine
CID 166728027
3-bromo-N,2,2-trimethyl-N-(2-propan-2-yloxyethyl)propan-1-amine
CID 81062792
2-methyl-2-(methylamino)-3-[methyl(2-propan-2-yloxyethyl)amino]propan-1-ol
CID 81065082
2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide
CID 81061565
2-ethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]butan-1-ol
CID 81074442
2-cyclopropyl-3-[methyl(2-propan-2-yloxyethyl)amino]-2-(propylamino)propanoic acid
CID 81074286
(2S)-3-(dimethylamino)-2-hydroxy-2-methylpropanoic acid
CID 55302369
2,2-dimethyl-3-[methyl(2-propan-2-yloxyethyl)amino]-1-phenylpropan-1-ol
CID 81074892

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid?
The IUPAC name of 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid (CID 81056783) is 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid.
What is the SMILES notation for 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid?
The canonical SMILES for 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid is CC(C)OCCN(C)CC(C)(O)C(=O)O.
What is the InChIKey of 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid?
The InChIKey is YZKCZLHESYFWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-8(2)15-6-5-11(4)7-10(3,14)9(12)13/h8,14H,5-7H2,1-4H3,(H,12,13).
What are the key properties of 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid?
2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid has a molecular weight of 219.28 g/mol, XLogP of 0.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid is sourced from PubChem (CID 81056783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).