[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine

C13H26N2O2 — CID 82719280

IUPAC[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine
SMILESCC1CN(C2(CN)CCOC2C)CC(C)(C)O1
InChIInChI=1S/C13H26N2O2/c1-10-7-15(9-12(3,4)17-10)13(8-14)5-6-16-11(13)2/h10-11H,5-9,14H2,1-4H3
InChIKeyFIKITVDMNIYDNV-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.99
Rot. Bonds2

About [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine

[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine (PubChem CID 82719280) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine.

Molecular Properties

Compound Name[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine
PubChem CID82719280
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine
SMILESCC1CN(C2(CN)CCOC2C)CC(C)(C)O1
InChIInChI=1S/C13H26N2O2/c1-10-7-15(9-12(3,4)17-10)13(8-14)5-6-16-11(13)2/h10-11H,5-9,14H2,1-4H3
InChIKeyFIKITVDMNIYDNV-UHFFFAOYSA-N
XLogP0.99
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine?
The IUPAC name of [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine (CID 82719280) is [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine.
What is the SMILES notation for [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine?
The canonical SMILES for [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine is CC1CN(C2(CN)CCOC2C)CC(C)(C)O1.
What is the InChIKey of [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine?
The InChIKey is FIKITVDMNIYDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10-7-15(9-12(3,4)17-10)13(8-14)5-6-16-11(13)2/h10-11H,5-9,14H2,1-4H3.
What are the key properties of [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine?
[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine has a molecular weight of 242.36 g/mol, XLogP of 0.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine is sourced from PubChem (CID 82719280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).