1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine

C10H21NO2 — CID 114534229

IUPAC1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
SMILESCCOCC1(CNC)CCOC1C
InChIInChI=1S/C10H21NO2/c1-4-12-8-10(7-11-3)5-6-13-9(10)2/h9,11H,4-8H2,1-3H3
InChIKeyUBULQAULRVRFAC-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.04
Rot. Bonds5

About 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine

1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine (PubChem CID 114534229) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
PubChem CID114534229
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
SMILESCCOCC1(CNC)CCOC1C
InChIInChI=1S/C10H21NO2/c1-4-12-8-10(7-11-3)5-6-13-9(10)2/h9,11H,4-8H2,1-3H3
InChIKeyUBULQAULRVRFAC-UHFFFAOYSA-N
XLogP1.04
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine (CID 114534229) is 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine is CCOCC1(CNC)CCOC1C.
What is the InChIKey of 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
The InChIKey is UBULQAULRVRFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-4-12-8-10(7-11-3)5-6-13-9(10)2/h9,11H,4-8H2,1-3H3.
What are the key properties of 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine has a molecular weight of 187.28 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 114534229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).