methyl 2-[methyl(prop-2-enyl)amino]acetate

C7H13NO2 — CID 60670358

IUPACmethyl 2-[methyl(prop-2-enyl)amino]acetate
SMILESC=CCN(C)CC(=O)OC
InChIInChI=1S/C7H13NO2/c1-4-5-8(2)6-7(9)10-3/h4H,1,5-6H2,2-3H3
InChIKeyZXTBCLRJPBHPPV-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.28
Rot. Bonds4

About methyl 2-[methyl(prop-2-enyl)amino]acetate

methyl 2-[methyl(prop-2-enyl)amino]acetate (PubChem CID 60670358) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is methyl 2-[methyl(prop-2-enyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl(prop-2-enyl)amino]acetate
PubChem CID60670358
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Namemethyl 2-[methyl(prop-2-enyl)amino]acetate
SMILESC=CCN(C)CC(=O)OC
InChIInChI=1S/C7H13NO2/c1-4-5-8(2)6-7(9)10-3/h4H,1,5-6H2,2-3H3
InChIKeyZXTBCLRJPBHPPV-UHFFFAOYSA-N
XLogP0.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,N-Di-2-propen-1-ylglycine ethyl ester
CID 17541
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N,N-diethyl-N-(2-methoxy-2-oxoethyl)-3-methylbut-2-en-1-aminium chloride
CID 16188341
Methyl 2-[diethyl(3-methylbut-2-enyl)amino]acetate
CID 1576368
Methyl 2-[(prop-2-en-1-yl)amino]acetate
CID 13454969
N-allylsarcosine ethyl ester
CID 21403446
2-[Bis(prop-2-enyl)amino]ethyl acetate
CID 58105020
N,N-dimethyl-N-[2-oxo-2-(prop-2-yn-1-yloxy)ethyl]prop-2-en-1-aminium
CID 1600802
methyl 2-[[(E)-but-2-enyl]-methylamino]acetate
CID 11051912
Allyl(dimethyl)-(methoxycarbonylmethyl)ammonium bromide
CID 12130473
Methyl 2-[but-3-enyl(methyl)amino]acetate
CID 15360741
Methyl 2-[(2-methoxy-2-oxoethyl)-prop-2-enylamino]acetate
CID 60754308

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl(prop-2-enyl)amino]acetate?
The IUPAC name of methyl 2-[methyl(prop-2-enyl)amino]acetate (CID 60670358) is methyl 2-[methyl(prop-2-enyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl(prop-2-enyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl(prop-2-enyl)amino]acetate is C=CCN(C)CC(=O)OC.
What is the InChIKey of methyl 2-[methyl(prop-2-enyl)amino]acetate?
The InChIKey is ZXTBCLRJPBHPPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-4-5-8(2)6-7(9)10-3/h4H,1,5-6H2,2-3H3.
What are the key properties of methyl 2-[methyl(prop-2-enyl)amino]acetate?
methyl 2-[methyl(prop-2-enyl)amino]acetate has a molecular weight of 143.19 g/mol, XLogP of 0.28, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl(prop-2-enyl)amino]acetate is sourced from PubChem (CID 60670358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).