ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine

C11H25NO — CID 176955028

IUPACethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine
SMILESCC.CCC1(CCOC)CN(C)C1
InChIInChI=1S/C9H19NO.C2H6/c1-4-9(5-6-11-3)7-10(2)8-9;1-2/h4-8H2,1-3H3;1-2H3
InChIKeyGEAAWCFHMWTFHZ-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.39
Rot. Bonds4

About ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine

ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine (PubChem CID 176955028) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine.

Molecular Properties

Compound Nameethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine
PubChem CID176955028
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Nameethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine
SMILESCC.CCC1(CCOC)CN(C)C1
InChIInChI=1S/C9H19NO.C2H6/c1-4-9(5-6-11-3)7-10(2)8-9;1-2/h4-8H2,1-3H3;1-2H3
InChIKeyGEAAWCFHMWTFHZ-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-3-(2-methoxyethyl)-1-methylpyrrolidine
CID 164595752
3-ethyl-3-(methoxymethyl)-1-methylpyrrolidine
CID 130347228
3,3-diethyl-1-methylpyrrolidine;ethane
CID 177188289
ethane;1-(2-methoxyethyl)-1-(methoxymethyl)cyclopentane
CID 143807089
1-(2-methoxyethyl)-1-propylcyclobutane
CID 164846249
1-(4-ethylpiperidin-4-yl)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]methanamine
CID 114113003
ethane;2-ethyl-2-(2-methoxyethyl)azetidine
CID 168995491
ethane;[1-(2-methoxyethyl)cyclobutyl]methanamine
CID 156798324
ethane;3-ethyl-3-fluoro-1-[2-(2-methoxyethoxy)ethyl]azetidine
CID 177319476
1-[1-(2-methoxyethyl)cyclobutyl]-N-methylmethanamine
CID 65194306
1-(3-ethyl-1-methylpyrrolidin-3-yl)-N,N-dimethylmethanamine
CID 129233925
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylpentan-2-amine
CID 115894858

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine?
The IUPAC name of ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine (CID 176955028) is ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine.
What is the SMILES notation for ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine?
The canonical SMILES for ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine is CC.CCC1(CCOC)CN(C)C1.
What is the InChIKey of ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine?
The InChIKey is GEAAWCFHMWTFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO.C2H6/c1-4-9(5-6-11-3)7-10(2)8-9;1-2/h4-8H2,1-3H3;1-2H3.
What are the key properties of ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine?
ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine has a molecular weight of 187.33 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-3-(2-methoxyethyl)-1-methylazetidine is sourced from PubChem (CID 176955028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).