1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine

C14H28N2O2 — CID 63740106

IUPAC1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
SMILESCNCC1(CN2CC(C)OC(C)C2)CCCOC1
InChIInChI=1S/C14H28N2O2/c1-12-7-16(8-13(2)18-12)10-14(9-15-3)5-4-6-17-11-14/h12-13,15H,4-11H2,1-3H3
InChIKeyQUYMSRKTFCFREA-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.11
Rot. Bonds4

About 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine

1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine (PubChem CID 63740106) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
PubChem CID63740106
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
SMILESCNCC1(CN2CC(C)OC(C)C2)CCCOC1
InChIInChI=1S/C14H28N2O2/c1-12-7-16(8-13(2)18-12)10-14(9-15-3)5-4-6-17-11-14/h12-13,15H,4-11H2,1-3H3
InChIKeyQUYMSRKTFCFREA-UHFFFAOYSA-N
XLogP1.11
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine (CID 63740106) is 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine is CNCC1(CN2CC(C)OC(C)C2)CCCOC1.
What is the InChIKey of 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine?
The InChIKey is QUYMSRKTFCFREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-12-7-16(8-13(2)18-12)10-14(9-15-3)5-4-6-17-11-14/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine?
1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine has a molecular weight of 256.39 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(2,6-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 63740106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).