3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate

C10H21NO5 — CID 177295921

IUPAC3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate
SMILESCNC(=O)OCCCOCCOCCOC
InChIInChI=1S/C10H21NO5/c1-11-10(12)16-5-3-4-14-8-9-15-7-6-13-2/h3-9H2,1-2H3,(H,11,12)
InChIKeyROWKHXDTFFROPH-UHFFFAOYSA-N
MW235.28 g/mol
LogP0.41
Rot. Bonds10

About 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate

3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate (PubChem CID 177295921) has the molecular formula C10H21NO5 and a molecular weight of 235.28 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate
PubChem CID177295921
Molecular FormulaC10H21NO5
Molecular Weight235.28 g/mol
Exact Mass235.14
IUPAC Name3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate
SMILESCNC(=O)OCCCOCCOCCOC
InChIInChI=1S/C10H21NO5/c1-11-10(12)16-5-3-4-14-8-9-15-7-6-13-2/h3-9H2,1-2H3,(H,11,12)
InChIKeyROWKHXDTFFROPH-UHFFFAOYSA-N
XLogP0.41
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[3-[2-(2-methoxyethoxy)ethoxy]propoxy]ethoxy]ethanamine
CID 146320426
2-[2-[3-(2-methoxyethoxy)propoxy]ethoxy]ethanamine
CID 103482612
5-(methylcarbamoyloxy)pentyl N-methylcarbamate
CID 59800394
3-(2-methoxyethoxy)propyl 2-methoxyethyl carbonate
CID 87247503
4-[3-(2-methoxyethoxy)propoxy]-N-methylbutanamide
CID 134579969
4-(2-methoxyethoxy)butyl methyl carbonate
CID 87247594
2-[2-(3-methoxypropoxy)ethoxy]-N-methylacetamide
CID 134579961
2-[2-(2-iodoethoxy)ethoxy]ethyl N-methylcarbamate
CID 158533955
2-[2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl N-methylcarbamate
CID 142392004
2-[2-(methylamino)ethoxy]ethyl N-methylcarbamate
CID 87799923
2-(2-chloroethoxy)ethyl N-methylcarbamate
CID 103970595
2-[2-(3-methoxypropoxy)ethoxy]ethanamine
CID 103175799

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate?
The IUPAC name of 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate (CID 177295921) is 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate?
The canonical SMILES for 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate is CNC(=O)OCCCOCCOCCOC.
What is the InChIKey of 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate?
The InChIKey is ROWKHXDTFFROPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO5/c1-11-10(12)16-5-3-4-14-8-9-15-7-6-13-2/h3-9H2,1-2H3,(H,11,12).
What are the key properties of 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate?
3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate has a molecular weight of 235.28 g/mol, XLogP of 0.41, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate is sourced from PubChem (CID 177295921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).