methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate

C10H19NO5 — CID 18997974

IUPACmethoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate
SMILESC=CC(=O)NC(O)C(=O)OC(C)C.COC
InChIInChI=1S/C8H13NO4.C2H6O/c1-4-6(10)9-7(11)8(12)13-5(2)3;1-3-2/h4-5,7,11H,1H2,2-3H3,(H,9,10);1-2H3
InChIKeyFJPJANIEIHBXCD-UHFFFAOYSA-N
MW233.26 g/mol
LogP-0.18
Rot. Bonds4

About methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate

methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate (PubChem CID 18997974) has the molecular formula C10H19NO5 and a molecular weight of 233.26 g/mol. Its IUPAC name is methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate.

Molecular Properties

Compound Namemethoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate
PubChem CID18997974
Molecular FormulaC10H19NO5
Molecular Weight233.26 g/mol
Exact Mass233.13
IUPAC Namemethoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate
SMILESC=CC(=O)NC(O)C(=O)OC(C)C.COC
InChIInChI=1S/C8H13NO4.C2H6O/c1-4-6(10)9-7(11)8(12)13-5(2)3;1-3-2/h4-5,7,11H,1H2,2-3H3,(H,9,10);1-2H3
InChIKeyFJPJANIEIHBXCD-UHFFFAOYSA-N
XLogP-0.18
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate?
The IUPAC name of methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate (CID 18997974) is methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate.
What is the SMILES notation for methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate?
The canonical SMILES for methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate is C=CC(=O)NC(O)C(=O)OC(C)C.COC.
What is the InChIKey of methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate?
The InChIKey is FJPJANIEIHBXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO4.C2H6O/c1-4-6(10)9-7(11)8(12)13-5(2)3;1-3-2/h4-5,7,11H,1H2,2-3H3,(H,9,10);1-2H3.
What are the key properties of methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate?
methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate has a molecular weight of 233.26 g/mol, XLogP of -0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;propan-2-yl 2-hydroxy-2-(prop-2-enoylamino)acetate is sourced from PubChem (CID 18997974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).