1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine

C7H15NO2 — CID 129125937

IUPAC1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine
SMILESCCC1OCOC1CNC
InChIInChI=1S/C7H15NO2/c1-3-6-7(4-8-2)10-5-9-6/h6-8H,3-5H2,1-2H3
InChIKeyDUQBCLAGRUAOME-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.36
Rot. Bonds3

About 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine

1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine (PubChem CID 129125937) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine
PubChem CID129125937
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine
SMILESCCC1OCOC1CNC
InChIInChI=1S/C7H15NO2/c1-3-6-7(4-8-2)10-5-9-6/h6-8H,3-5H2,1-2H3
InChIKeyDUQBCLAGRUAOME-UHFFFAOYSA-N
XLogP0.36
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-diethyl-1,3-dioxolane;2,3-diethyloxirane
CID 142047920
(4R)-4,8-diethyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
CID 58960567
N-methyl-1-(3-methyloxetan-2-yl)methanamine
CID 123426765
(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
CID 130254477
(4R,4aR,8R,8aR)-8-ethyl-4-prop-2-ynyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
CID 144837078
ethane;1-(4-ethylcyclohexyl)-N-methylmethanamine
CID 166157734
ethane;N-methyl-1-(5-methyloxolan-3-yl)methanamine
CID 143946958
CID 172625443
CID 172625443
1-(3,3a,4,5,7,7a-hexahydro-2H-thieno[2,3-c]pyran-7-yl)-N-methylmethanamine
CID 146653292
(3S,4S)-3,4-diethyldioxetane
CID 71414825
1-(3-ethyl-1-methylphosphetan-2-yl)-N-methylmethanamine
CID 129152153
4,5-bis(ethylsulfinylmethyl)-1,3-dioxolane
CID 71149111

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine (CID 129125937) is 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine is CCC1OCOC1CNC.
What is the InChIKey of 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine?
The InChIKey is DUQBCLAGRUAOME-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-3-6-7(4-8-2)10-5-9-6/h6-8H,3-5H2,1-2H3.
What are the key properties of 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine?
1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine has a molecular weight of 145.20 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine is sourced from PubChem (CID 129125937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).