3-(decoxymethyl)-1,3-oxazolidine

C14H29NO2 — CID 164576948

IUPAC3-(decoxymethyl)-1,3-oxazolidine
SMILESCCCCCCCCCCOCN1CCOC1
InChIInChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-11-16-13-15-10-12-17-14-15/h2-14H2,1H3
InChIKeyRNCMBBDFGSHQGK-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.39
Rot. Bonds11

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

3-(decoxymethyl)-1,3-oxazolidine (PubChem CID 164576948) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 3-(decoxymethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name3-(decoxymethyl)-1,3-oxazolidine
PubChem CID164576948
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name3-(decoxymethyl)-1,3-oxazolidine
SMILESCCCCCCCCCCOCN1CCOC1
InChIInChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-11-16-13-15-10-12-17-14-15/h2-14H2,1H3
InChIKeyRNCMBBDFGSHQGK-UHFFFAOYSA-N
XLogP3.39
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.39
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

2-Heptyl-3-methyl-1,3-oxazolidine
CID 21596985
3-[(Pentyloxy)methyl]-1,3-oxazolidine
CID 164576907
3-[(Hexyloxy)methyl]-1,3-oxazolidine
CID 164576911
3-[(Heptyloxy)methyl]-1,3-oxazolidine
CID 164576923
3-[(Octyloxy)methyl]-1,3-oxazolidine
CID 164576930
3-[(Nonyloxy)methyl]-1,3-oxazolidine
CID 164576944
3-[(Undecyloxy)methyl]-1,3-oxazolidine
CID 164576959
(2R)-2-heptyl-3-methyl-1,3-oxazolidine
CID 641510
2-decoxy-N,N-dimethylethanamine
CID 14389663
N,N-dimethyl-2-nonoxyethanamine
CID 15544777
N,N-dimethyl-2-octoxyethanamine
CID 21540565
3-Ethyl-2-octyl-1,3-oxazolidine
CID 22996835

Frequently Asked Questions

What is the IUPAC name of 3-(decoxymethyl)-1,3-oxazolidine?
The IUPAC name of 3-(decoxymethyl)-1,3-oxazolidine (CID 164576948) is 3-(decoxymethyl)-1,3-oxazolidine.
What is the SMILES notation for 3-(decoxymethyl)-1,3-oxazolidine?
The canonical SMILES for 3-(decoxymethyl)-1,3-oxazolidine is CCCCCCCCCCOCN1CCOC1.
What is the InChIKey of 3-(decoxymethyl)-1,3-oxazolidine?
The InChIKey is RNCMBBDFGSHQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-11-16-13-15-10-12-17-14-15/h2-14H2,1H3.
What are the key properties of 3-(decoxymethyl)-1,3-oxazolidine?
3-(decoxymethyl)-1,3-oxazolidine has a molecular weight of 243.39 g/mol, XLogP of 3.39, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(decoxymethyl)-1,3-oxazolidine is sourced from PubChem (CID 164576948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).