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

C7H13NO4 — CID 115909635

IUPAC2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid
SMILESCOC(C)(C)C(=O)NCC(=O)O
InChIInChI=1S/C7H13NO4/c1-7(2,12-3)6(11)8-4-5(9)10/h4H2,1-3H3,(H,8,11)(H,9,10)
InChIKeyTUMZJPPIJHEWRZ-UHFFFAOYSA-N
MW175.18 g/mol
LogP-0.39
Rot. Bonds4

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

2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid (PubChem CID 115909635) has the molecular formula C7H13NO4 and a molecular weight of 175.18 g/mol. Its IUPAC name is 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid
PubChem CID115909635
Molecular FormulaC7H13NO4
Molecular Weight175.18 g/mol
Exact Mass175.08
IUPAC Name2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid
SMILESCOC(C)(C)C(=O)NCC(=O)O
InChIInChI=1S/C7H13NO4/c1-7(2,12-3)6(11)8-4-5(9)10/h4H2,1-3H3,(H,8,11)(H,9,10)
InChIKeyTUMZJPPIJHEWRZ-UHFFFAOYSA-N
XLogP-0.39
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.18
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-3-[(2-methoxy-2-methylpropanoyl)amino]-2-methylpropanoic acid
CID 103018889
N-(2,2-dimethoxyethyl)-2-methoxy-2-methylpropanamide
CID 103020556
N-[(4-hydroxycyclohexyl)methyl]-2-methoxy-2-methylpropanamide
CID 106123782
2-(2,2-diethylbutanoylamino)acetic acid
CID 88907471
N-(2-amino-2-ethylbutyl)-2-methoxy-2-methylpropanamide
CID 103021621
2-(2,2-diacetamidopropanoylamino)acetic acid
CID 82254402
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-2-methoxy-2-methylpropanamide
CID 113258787
4-[[(2-methoxy-2-methylpropanoyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 103018968
N-(2,2-dicyclopropylethyl)-2-methoxy-2-methylpropanamide
CID 103709266
2-[[2-(2,2-dimethylbutanoylamino)acetyl]amino]acetic acid
CID 62677817
3-[(2-methoxy-2-methylpropanoyl)amino]-5,5-dimethylhexanoic acid
CID 103019288
N-(5-amino-2,2-dimethylpentyl)-2-methoxy-2-methylpropanamide
CID 106140447

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid?
The IUPAC name of 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid (CID 115909635) is 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid.
What is the SMILES notation for 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid?
The canonical SMILES for 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid is COC(C)(C)C(=O)NCC(=O)O.
What is the InChIKey of 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid?
The InChIKey is TUMZJPPIJHEWRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO4/c1-7(2,12-3)6(11)8-4-5(9)10/h4H2,1-3H3,(H,8,11)(H,9,10).
What are the key properties of 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid?
2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid has a molecular weight of 175.18 g/mol, XLogP of -0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxy-2-methylpropanoyl)amino]acetic acid is sourced from PubChem (CID 115909635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).