3-(propoxymethyl)-1,3-oxazolidine

C7H15NO2 — CID 86184530

IUPAC3-(propoxymethyl)-1,3-oxazolidine
SMILESCCCOCN1CCOC1
InChIInChI=1S/C7H15NO2/c1-2-4-9-6-8-3-5-10-7-8/h2-7H2,1H3
InChIKeyMRYFURCZEOONHQ-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.66
Rot. Bonds4

About 3-(propoxymethyl)-1,3-oxazolidine

3-(propoxymethyl)-1,3-oxazolidine (PubChem CID 86184530) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 3-(propoxymethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name3-(propoxymethyl)-1,3-oxazolidine
PubChem CID86184530
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name3-(propoxymethyl)-1,3-oxazolidine
SMILESCCCOCN1CCOC1
InChIInChI=1S/C7H15NO2/c1-2-4-9-6-8-3-5-10-7-8/h2-7H2,1H3
InChIKeyMRYFURCZEOONHQ-UHFFFAOYSA-N
XLogP0.66
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Oxazolidine, 3-methyl-
CID 214264
Oxazolidine, 2,2,3-trimethyl-
CID 254199
3,4,4-Trimethyloxazolidine
CID 62271
3,3-Dimethyl-1,3-oxazolidin-3-ium bromide
CID 14859589
3,3,5-Trimethyl-1,3-oxazolidin-3-ium bromide
CID 14859591
3-Butyl-1,3-oxazolidine
CID 12589268
Oxazolidine, 2-ethyl-3-methyl-
CID 559469
1-(2-Methoxyethyl)pyrrolidine
CID 12183844
3-Propyl-1,3-oxazolidine
CID 12541791
3-(Butoxymethyl)-1,3-oxazolidine
CID 14496315
3-[(2-Methylpropoxy)methyl]-1,3-oxazolidine
CID 154368992
2-(Methoxymethyl)-3-methyl-1,3-oxazolidine
CID 388444

Frequently Asked Questions

What is the IUPAC name of 3-(propoxymethyl)-1,3-oxazolidine?
The IUPAC name of 3-(propoxymethyl)-1,3-oxazolidine (CID 86184530) is 3-(propoxymethyl)-1,3-oxazolidine.
What is the SMILES notation for 3-(propoxymethyl)-1,3-oxazolidine?
The canonical SMILES for 3-(propoxymethyl)-1,3-oxazolidine is CCCOCN1CCOC1.
What is the InChIKey of 3-(propoxymethyl)-1,3-oxazolidine?
The InChIKey is MRYFURCZEOONHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-2-4-9-6-8-3-5-10-7-8/h2-7H2,1H3.
What are the key properties of 3-(propoxymethyl)-1,3-oxazolidine?
3-(propoxymethyl)-1,3-oxazolidine has a molecular weight of 145.20 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(propoxymethyl)-1,3-oxazolidine is sourced from PubChem (CID 86184530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).