[3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine

C12H24N2O2 — CID 82717624

IUPAC[3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine
SMILESCC1CN(C2(CN)CCOC2C)CC(C)O1
InChIInChI=1S/C12H24N2O2/c1-9-6-14(7-10(2)16-9)12(8-13)4-5-15-11(12)3/h9-11H,4-8,13H2,1-3H3
InChIKeyJSOQYDITQWRZPL-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.60
Rot. Bonds2

About [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine

[3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine (PubChem CID 82717624) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine.

Molecular Properties

Compound Name[3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine
PubChem CID82717624
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name[3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine
SMILESCC1CN(C2(CN)CCOC2C)CC(C)O1
InChIInChI=1S/C12H24N2O2/c1-9-6-14(7-10(2)16-9)12(8-13)4-5-15-11(12)3/h9-11H,4-8,13H2,1-3H3
InChIKeyJSOQYDITQWRZPL-UHFFFAOYSA-N
XLogP0.60
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine?
The IUPAC name of [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine (CID 82717624) is [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine.
What is the SMILES notation for [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine?
The canonical SMILES for [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine is CC1CN(C2(CN)CCOC2C)CC(C)O1.
What is the InChIKey of [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine?
The InChIKey is JSOQYDITQWRZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9-6-14(7-10(2)16-9)12(8-13)4-5-15-11(12)3/h9-11H,4-8,13H2,1-3H3.
What are the key properties of [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine?
[3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine has a molecular weight of 228.34 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,6-dimethylmorpholin-4-yl)-2-methyloxolan-3-yl]methanamine is sourced from PubChem (CID 82717624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).