methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate

C10H21NO4 — CID 60904481

IUPACmethyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate
SMILESCOC(=O)CNCC(O)COCC(C)C
InChIInChI=1S/C10H21NO4/c1-8(2)6-15-7-9(12)4-11-5-10(13)14-3/h8-9,11-12H,4-7H2,1-3H3
InChIKeyPVGZKSIMUCGHCM-UHFFFAOYSA-N
MW219.28 g/mol
LogP-0.22
Rot. Bonds8

About methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate

methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate (PubChem CID 60904481) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate.

Molecular Properties

Compound Namemethyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate
PubChem CID60904481
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Namemethyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate
SMILESCOC(=O)CNCC(O)COCC(C)C
InChIInChI=1S/C10H21NO4/c1-8(2)6-15-7-9(12)4-11-5-10(13)14-3/h8-9,11-12H,4-7H2,1-3H3
InChIKeyPVGZKSIMUCGHCM-UHFFFAOYSA-N
XLogP-0.22
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(2-methylpropylamino)acetate
CID 22175789
methyl 2-[[3-(2-ethylhexoxy)-2-hydroxypropyl]amino]acetate
CID 60902673
1-(methoxyamino)-3-(2-methylpropoxy)propan-2-ol
CID 60702508
1-(3-methylbutylamino)-3-(2-methylpropoxy)propan-2-ol
CID 60633825
1-[(3-methyl-2-propan-2-ylbutyl)amino]-3-(2-methylpropoxy)propan-2-ol
CID 102905545
1-(2-methylbutylamino)-3-(2-methylpropoxy)propan-2-ol
CID 62692862
methyl 2-[[3-[(2-fluorophenyl)methoxy]-2-hydroxypropyl]amino]acetate
CID 60649043
methyl 2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]acetate
CID 60904602
methyl 2-(2-aminopropylamino)acetate
CID 54010376
methyl 2-(2-iodopropylamino)acetate
CID 163571817
methyl 2-[[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]amino]acetate
CID 60904477
methyl 2-[[3-(4-fluorophenoxy)-2-hydroxypropyl]amino]acetate
CID 60904479

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate?
The IUPAC name of methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate (CID 60904481) is methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate.
What is the SMILES notation for methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate?
The canonical SMILES for methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate is COC(=O)CNCC(O)COCC(C)C.
What is the InChIKey of methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate?
The InChIKey is PVGZKSIMUCGHCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-8(2)6-15-7-9(12)4-11-5-10(13)14-3/h8-9,11-12H,4-7H2,1-3H3.
What are the key properties of methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate?
methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate has a molecular weight of 219.28 g/mol, XLogP of -0.22, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]acetate is sourced from PubChem (CID 60904481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).