methyl 2-[methyl(propanoyl)amino]acetate

C7H13NO3 — CID 43407357

IUPACmethyl 2-[methyl(propanoyl)amino]acetate
SMILESCCC(=O)N(C)CC(=O)OC
InChIInChI=1S/C7H13NO3/c1-4-6(9)8(2)5-7(10)11-3/h4-5H2,1-3H3
InChIKeyWNLKQHCXSPSMEG-UHFFFAOYSA-N
MW159.19 g/mol
LogP0.03
Rot. Bonds3

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

methyl 2-[methyl(propanoyl)amino]acetate (PubChem CID 43407357) has the molecular formula C7H13NO3 and a molecular weight of 159.19 g/mol. Its IUPAC name is methyl 2-[methyl(propanoyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl(propanoyl)amino]acetate
PubChem CID43407357
Molecular FormulaC7H13NO3
Molecular Weight159.19 g/mol
Exact Mass159.09
IUPAC Namemethyl 2-[methyl(propanoyl)amino]acetate
SMILESCCC(=O)N(C)CC(=O)OC
InChIInChI=1S/C7H13NO3/c1-4-6(9)8(2)5-7(10)11-3/h4-5H2,1-3H3
InChIKeyWNLKQHCXSPSMEG-UHFFFAOYSA-N
XLogP0.03
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[(2-methoxy-2-oxoethyl)-methylamino]-4-oxobutanoate
CID 43407383
propan-2-yl 2-[methyl(propanoyl)amino]acetate
CID 59695660
methyl 2-[3-aminopropanoyl(methyl)amino]acetate;hydrochloride
CID 155943272
methyl 2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-(methylamino)acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetate
CID 177128188
methyl 2-[methoxycarbonyl(methyl)amino]acetate;hydrochloride
CID 174628229
methyl 2-[diethylcarbamoyl(methyl)amino]acetate
CID 79161782
methyl 2-[3-(ethylamino)butanoyl-methylamino]acetate
CID 62839405
ethane;2-[methyl(propanoyl)amino]acetic acid
CID 170570723
methyl 2-[3-acetamidopropanoyl(methyl)amino]acetate
CID 43407517
5-[(2-methoxy-2-oxoethyl)-methylamino]-3,3-dimethyl-5-oxopentanoic acid
CID 62935261
methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate
CID 103520057
methyl 2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetate;propane
CID 142813889

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl(propanoyl)amino]acetate?
The IUPAC name of methyl 2-[methyl(propanoyl)amino]acetate (CID 43407357) is methyl 2-[methyl(propanoyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl(propanoyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl(propanoyl)amino]acetate is CCC(=O)N(C)CC(=O)OC.
What is the InChIKey of methyl 2-[methyl(propanoyl)amino]acetate?
The InChIKey is WNLKQHCXSPSMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3/c1-4-6(9)8(2)5-7(10)11-3/h4-5H2,1-3H3.
What are the key properties of methyl 2-[methyl(propanoyl)amino]acetate?
methyl 2-[methyl(propanoyl)amino]acetate has a molecular weight of 159.19 g/mol, XLogP of 0.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl(propanoyl)amino]acetate is sourced from PubChem (CID 43407357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).