methyl 2-(2-aminoethoxy)propanoate;hydrochloride

C6H14ClNO3 — CID 175589324

IUPACmethyl 2-(2-aminoethoxy)propanoate;hydrochloride
SMILESCOC(=O)C(C)OCCN.Cl
InChIInChI=1S/C6H13NO3.ClH/c1-5(6(8)9-2)10-4-3-7;/h5H,3-4,7H2,1-2H3;1H
InChIKeyYIDINWLPQBARSO-UHFFFAOYSA-N
MW183.63 g/mol
LogP-0.05
Rot. Bonds4

About methyl 2-(2-aminoethoxy)propanoate;hydrochloride

methyl 2-(2-aminoethoxy)propanoate;hydrochloride (PubChem CID 175589324) has the molecular formula C6H14ClNO3 and a molecular weight of 183.63 g/mol. Its IUPAC name is methyl 2-(2-aminoethoxy)propanoate;hydrochloride.

Molecular Properties

Compound Namemethyl 2-(2-aminoethoxy)propanoate;hydrochloride
PubChem CID175589324
Molecular FormulaC6H14ClNO3
Molecular Weight183.63 g/mol
Exact Mass183.07
IUPAC Namemethyl 2-(2-aminoethoxy)propanoate;hydrochloride
SMILESCOC(=O)C(C)OCCN.Cl
InChIInChI=1S/C6H13NO3.ClH/c1-5(6(8)9-2)10-4-3-7;/h5H,3-4,7H2,1-2H3;1H
InChIKeyYIDINWLPQBARSO-UHFFFAOYSA-N
XLogP-0.05
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.63
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(2-hydroxyethoxy)propanoate
CID 15099863
methyl 2-(2-ethoxyethoxy)propanoate
CID 61234478
methyl (2S)-2-hexoxypropanoate
CID 103337819
methyl 2-dodecoxypropanoate
CID 86244254
methyl (2S)-2-(3-methylbut-3-enoxy)propanoate
CID 103338255
methyl 2-methoxypropanoate;hydrochloride
CID 174449160
methyl (2R)-2-(2-butoxyethoxy)propanoate
CID 103337806
2-(2-aminoethoxy)-N-(methylcarbamoyl)propanamide
CID 106938050
2-(2-aminoethoxy)-N-prop-2-ynylpropanamide
CID 62342840
methyl 2-(2-cyclobutylethoxy)propanoate
CID 106199364
methyl (2S)-2-(aminomethoxycarbonyloxy)propanoate
CID 155065412
methyl (2S)-2-(3-phenylpropoxy)propanoate
CID 103337960

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-aminoethoxy)propanoate;hydrochloride?
The IUPAC name of methyl 2-(2-aminoethoxy)propanoate;hydrochloride (CID 175589324) is methyl 2-(2-aminoethoxy)propanoate;hydrochloride.
What is the SMILES notation for methyl 2-(2-aminoethoxy)propanoate;hydrochloride?
The canonical SMILES for methyl 2-(2-aminoethoxy)propanoate;hydrochloride is COC(=O)C(C)OCCN.Cl.
What is the InChIKey of methyl 2-(2-aminoethoxy)propanoate;hydrochloride?
The InChIKey is YIDINWLPQBARSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3.ClH/c1-5(6(8)9-2)10-4-3-7;/h5H,3-4,7H2,1-2H3;1H.
What are the key properties of methyl 2-(2-aminoethoxy)propanoate;hydrochloride?
methyl 2-(2-aminoethoxy)propanoate;hydrochloride has a molecular weight of 183.63 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-aminoethoxy)propanoate;hydrochloride is sourced from PubChem (CID 175589324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).