4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide

C10H20N2O4 — CID 58978836

IUPAC4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide
SMILESCNCCNC(=O)C1CC(O)C(COC)O1
InChIInChI=1S/C10H20N2O4/c1-11-3-4-12-10(14)8-5-7(13)9(16-8)6-15-2/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyIGHYCDZBWDVYHS-UHFFFAOYSA-N
MW232.28 g/mol
LogP-1.51
Rot. Bonds6

About 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide

4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide (PubChem CID 58978836) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide
PubChem CID58978836
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC Name4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide
SMILESCNCCNC(=O)C1CC(O)C(COC)O1
InChIInChI=1S/C10H20N2O4/c1-11-3-4-12-10(14)8-5-7(13)9(16-8)6-15-2/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyIGHYCDZBWDVYHS-UHFFFAOYSA-N
XLogP-1.51
TPSA79.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide?
The IUPAC name of 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide (CID 58978836) is 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide.
What is the SMILES notation for 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide?
The canonical SMILES for 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide is CNCCNC(=O)C1CC(O)C(COC)O1.
What is the InChIKey of 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide?
The InChIKey is IGHYCDZBWDVYHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-11-3-4-12-10(14)8-5-7(13)9(16-8)6-15-2/h7-9,11,13H,3-6H2,1-2H3,(H,12,14).
What are the key properties of 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide?
4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide has a molecular weight of 232.28 g/mol, XLogP of -1.51, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-5-(methoxymethyl)-N-[2-(methylamino)ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 58978836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).