methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate

C8H15NO3 — CID 28585559

IUPACmethyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate
SMILESCOC(=O)CNC[C@H]1CCCO1
InChIInChI=1S/C8H15NO3/c1-11-8(10)6-9-5-7-3-2-4-12-7/h7,9H,2-6H2,1H3/t7-/m1/s1
InChIKeyWKBRUTKHRZTWIA-SSDOTTSWSA-N
MW173.21 g/mol
LogP-0.07
Rot. Bonds4

About methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate

methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate (PubChem CID 28585559) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate
PubChem CID28585559
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Namemethyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate
SMILESCOC(=O)CNC[C@H]1CCCO1
InChIInChI=1S/C8H15NO3/c1-11-8(10)6-9-5-7-3-2-4-12-7/h7,9H,2-6H2,1H3/t7-/m1/s1
InChIKeyWKBRUTKHRZTWIA-SSDOTTSWSA-N
XLogP-0.07
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[2-(oxolan-2-ylmethylamino)acetyl]amino]propanoate;hydrochloride
CID 119726630
N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 7437120
methyl 3-(oxolan-2-ylmethyl)but-3-enoate
CID 117268632
methyl 4-oxo-4-(oxolan-2-ylmethylamino)butanoate
CID 112511188
1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
CID 3607647
2-[(oxolan-2-ylmethylamino)methyl]prop-2-enoic acid
CID 103234748
oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 175652932
N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119672529
N-methyl-2-(oxolan-2-ylmethylamino)-N-propan-2-ylacetamide
CID 43180164
methyl 2-[bis(oxolan-2-ylmethyl)amino]acetate
CID 47039081
dimethyl 5-[[2-(oxolan-2-ylmethylamino)acetyl]amino]benzene-1,3-dicarboxylate
CID 119673692
1-(azepan-1-yl)-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
CID 7437129

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate?
The IUPAC name of methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate (CID 28585559) is methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate.
What is the SMILES notation for methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate?
The canonical SMILES for methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate is COC(=O)CNC[C@H]1CCCO1.
What is the InChIKey of methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate?
The InChIKey is WKBRUTKHRZTWIA-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H15NO3/c1-11-8(10)6-9-5-7-3-2-4-12-7/h7,9H,2-6H2,1H3/t7-/m1/s1.
What are the key properties of methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate?
methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate has a molecular weight of 173.21 g/mol, XLogP of -0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate is sourced from PubChem (CID 28585559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).