methyl 2-(ethylamino)acetate;hydrochloride

C5H12ClNO2 — CID 50988235

IUPACmethyl 2-(ethylamino)acetate;hydrochloride
SMILESCCNCC(=O)OC.Cl
InChIInChI=1S/C5H11NO2.ClH/c1-3-6-4-5(7)8-2;/h6H,3-4H2,1-2H3;1H
InChIKeyVMQZVSTVCJSFRQ-UHFFFAOYSA-N
MW153.61 g/mol
LogP0.19
Rot. Bonds3

About methyl 2-(ethylamino)acetate;hydrochloride

methyl 2-(ethylamino)acetate;hydrochloride (PubChem CID 50988235) has the molecular formula C5H12ClNO2 and a molecular weight of 153.61 g/mol. Its IUPAC name is methyl 2-(ethylamino)acetate;hydrochloride.

Molecular Properties

Compound Namemethyl 2-(ethylamino)acetate;hydrochloride
PubChem CID50988235
Molecular FormulaC5H12ClNO2
Molecular Weight153.61 g/mol
Exact Mass153.06
IUPAC Namemethyl 2-(ethylamino)acetate;hydrochloride
SMILESCCNCC(=O)OC.Cl
InChIInChI=1S/C5H11NO2.ClH/c1-3-6-4-5(7)8-2;/h6H,3-4H2,1-2H3;1H
InChIKeyVMQZVSTVCJSFRQ-UHFFFAOYSA-N
XLogP0.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.61
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-Ethylglycine
CID 316542
Ethyl N-methylaminoacetate hydrochloride
CID 171173
Methyl 2-acetamidoacetate
CID 517966
Diethyl iminodiacetate
CID 80502
Sarcosine methyl ester
CID 83545
Glycine, N-methyl-, ethyl ester
CID 95849
Ethyl 2-(ethylamino)acetate
CID 12591597
Glycine, N-methyl-, methyl ester, hydrochloride (1:1)
CID 83544
Dimethyl Iminodiacetate Hydrochloride
CID 2727727
Methyl 2-[(2-methoxy-2-oxoethyl)amino]acetate
CID 428827
(Ethylammonio)acetate
CID 6992079
Ethyl 2-((propan-2-yl)amino)acetate
CID 351625

Frequently Asked Questions

What is the IUPAC name of methyl 2-(ethylamino)acetate;hydrochloride?
The IUPAC name of methyl 2-(ethylamino)acetate;hydrochloride (CID 50988235) is methyl 2-(ethylamino)acetate;hydrochloride.
What is the SMILES notation for methyl 2-(ethylamino)acetate;hydrochloride?
The canonical SMILES for methyl 2-(ethylamino)acetate;hydrochloride is CCNCC(=O)OC.Cl.
What is the InChIKey of methyl 2-(ethylamino)acetate;hydrochloride?
The InChIKey is VMQZVSTVCJSFRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2.ClH/c1-3-6-4-5(7)8-2;/h6H,3-4H2,1-2H3;1H.
What are the key properties of methyl 2-(ethylamino)acetate;hydrochloride?
methyl 2-(ethylamino)acetate;hydrochloride has a molecular weight of 153.61 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(ethylamino)acetate;hydrochloride is sourced from PubChem (CID 50988235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).