2-[methyl(2-methylpropanoyl)amino]acetic acid

C7H13NO3 — CID 15640234

IUPAC2-[methyl(2-methylpropanoyl)amino]acetic acid
SMILESCC(C)C(=O)N(C)CC(=O)O
InChIInChI=1S/C7H13NO3/c1-5(2)7(11)8(3)4-6(9)10/h5H,4H2,1-3H3,(H,9,10)
InChIKeyOUZLKVNNBZFQRE-UHFFFAOYSA-N
MW159.18 g/mol
LogP0.19
Rot. Bonds3

About 2-[methyl(2-methylpropanoyl)amino]acetic acid

2-[methyl(2-methylpropanoyl)amino]acetic acid (PubChem CID 15640234) has the molecular formula C7H13NO3 and a molecular weight of 159.18 g/mol. Its IUPAC name is 2-[methyl(2-methylpropanoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[methyl(2-methylpropanoyl)amino]acetic acid
PubChem CID15640234
Molecular FormulaC7H13NO3
Molecular Weight159.18 g/mol
Exact Mass159.09
IUPAC Name2-[methyl(2-methylpropanoyl)amino]acetic acid
SMILESCC(C)C(=O)N(C)CC(=O)O
InChIInChI=1S/C7H13NO3/c1-5(2)7(11)8(3)4-6(9)10/h5H,4H2,1-3H3,(H,9,10)
InChIKeyOUZLKVNNBZFQRE-UHFFFAOYSA-N
XLogP0.19
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.18
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Isobutyrylglycine
CID 10855600
N-Acetyl-N-methylglycine
CID 10975514
[(3-Mercapto-2-methyl-propionyl)-methyl-amino]-acetic acid
CID 44373293
[Ethyl-(3-mercapto-2-methyl-propionyl)-amino]-acetic acid
CID 44373460
N-Methyl-N-(3-methyl-1-oxobutyl)glycine
CID 137394
2-(1-cyclopropyl-N-methylformamido)acetic acid
CID 16778147
2-methyl-2-(N-methylacetamido)propanoic acid
CID 23279431
N-acetyliminodiacetic acid
CID 10130190
N-Acetyl-N-methyl-L-alanine
CID 13094160
2-[N-(propan-2-yl)acetamido]acetic acid
CID 13930744
2-[Methyl(propionyl)amino]acetic acid
CID 15574472
3-Methyl-2-(N-methylacetamido)butanoic acid
CID 15640236

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2-methylpropanoyl)amino]acetic acid?
The IUPAC name of 2-[methyl(2-methylpropanoyl)amino]acetic acid (CID 15640234) is 2-[methyl(2-methylpropanoyl)amino]acetic acid.
What is the SMILES notation for 2-[methyl(2-methylpropanoyl)amino]acetic acid?
The canonical SMILES for 2-[methyl(2-methylpropanoyl)amino]acetic acid is CC(C)C(=O)N(C)CC(=O)O.
What is the InChIKey of 2-[methyl(2-methylpropanoyl)amino]acetic acid?
The InChIKey is OUZLKVNNBZFQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3/c1-5(2)7(11)8(3)4-6(9)10/h5H,4H2,1-3H3,(H,9,10).
What are the key properties of 2-[methyl(2-methylpropanoyl)amino]acetic acid?
2-[methyl(2-methylpropanoyl)amino]acetic acid has a molecular weight of 159.18 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2-methylpropanoyl)amino]acetic acid is sourced from PubChem (CID 15640234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).