methyl 2-[methyl(2-methylpropanoyl)amino]acetate

C8H15NO3 — CID 43409482

IUPACmethyl 2-[methyl(2-methylpropanoyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)C(C)C
InChIInChI=1S/C8H15NO3/c1-6(2)8(11)9(3)5-7(10)12-4/h6H,5H2,1-4H3
InChIKeyUDAFIYUWJLPNJI-UHFFFAOYSA-N
MW173.21 g/mol
LogP0.27
Rot. Bonds3

About methyl 2-[methyl(2-methylpropanoyl)amino]acetate

methyl 2-[methyl(2-methylpropanoyl)amino]acetate (PubChem CID 43409482) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is methyl 2-[methyl(2-methylpropanoyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl(2-methylpropanoyl)amino]acetate
PubChem CID43409482
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Namemethyl 2-[methyl(2-methylpropanoyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)C(C)C
InChIInChI=1S/C8H15NO3/c1-6(2)8(11)9(3)5-7(10)12-4/h6H,5H2,1-4H3
InChIKeyUDAFIYUWJLPNJI-UHFFFAOYSA-N
XLogP0.27
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Isobutyrylglycine, methyl ester
CID 4467317
2-(N,2-dimethylpropanamido)acetic acid
CID 15640234
(Acetyl-methoxycarbonylmethyl-amino)-acetic acid methyl ester
CID 224229
N-acetyl sarcosine O-methyl ester
CID 21718769
Methyl 2-[acetyl(methyl)amino]-3-methylbutanoate
CID 11019600
Sarcosine, n-pentafluoropropionyl-, isobutyl ester
CID 91730512
Glycine, N-pivaloyl-, methyl ester
CID 531532
Sarcosine, N-isobutyryl-, ethyl ester
CID 61597567
methyl 2-(3-(dimethylamino)-N-methylpropanamido)acetate hydrochloride
CID 165746593
Methyl 2-[acetyl(propan-2-yl)amino]acetate
CID 60766395
Sarcosine, N-cyclopropylcarbonyl-, ethyl ester
CID 54785103
Sarcosine, N-isobutyryl-, isobutyl ester
CID 91692123

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl(2-methylpropanoyl)amino]acetate?
The IUPAC name of methyl 2-[methyl(2-methylpropanoyl)amino]acetate (CID 43409482) is methyl 2-[methyl(2-methylpropanoyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl(2-methylpropanoyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl(2-methylpropanoyl)amino]acetate is COC(=O)CN(C)C(=O)C(C)C.
What is the InChIKey of methyl 2-[methyl(2-methylpropanoyl)amino]acetate?
The InChIKey is UDAFIYUWJLPNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3/c1-6(2)8(11)9(3)5-7(10)12-4/h6H,5H2,1-4H3.
What are the key properties of methyl 2-[methyl(2-methylpropanoyl)amino]acetate?
methyl 2-[methyl(2-methylpropanoyl)amino]acetate has a molecular weight of 173.21 g/mol, XLogP of 0.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl(2-methylpropanoyl)amino]acetate is sourced from PubChem (CID 43409482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).