4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol

C13H26N2O3 — CID 113269056

IUPAC4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol
SMILESCN1CCOC(CN(C)CC2(O)CCOCC2)C1
InChIInChI=1S/C13H26N2O3/c1-14-5-8-18-12(9-14)10-15(2)11-13(16)3-6-17-7-4-13/h12,16H,3-11H2,1-2H3
InChIKeyUOYFCZYNFUEVLZ-UHFFFAOYSA-N
MW258.36 g/mol
LogP-0.21
Rot. Bonds4

About 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol

4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol (PubChem CID 113269056) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol.

Molecular Properties

Compound Name4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol
PubChem CID113269056
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol
SMILESCN1CCOC(CN(C)CC2(O)CCOCC2)C1
InChIInChI=1S/C13H26N2O3/c1-14-5-8-18-12(9-14)10-15(2)11-13(16)3-6-17-7-4-13/h12,16H,3-11H2,1-2H3
InChIKeyUOYFCZYNFUEVLZ-UHFFFAOYSA-N
XLogP-0.21
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol?
The IUPAC name of 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol (CID 113269056) is 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol.
What is the SMILES notation for 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol?
The canonical SMILES for 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol is CN1CCOC(CN(C)CC2(O)CCOCC2)C1.
What is the InChIKey of 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol?
The InChIKey is UOYFCZYNFUEVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-14-5-8-18-12(9-14)10-15(2)11-13(16)3-6-17-7-4-13/h12,16H,3-11H2,1-2H3.
What are the key properties of 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol?
4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol has a molecular weight of 258.36 g/mol, XLogP of -0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl-[(4-methylmorpholin-2-yl)methyl]amino]methyl]oxan-4-ol is sourced from PubChem (CID 113269056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).