2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine

C11H24N2O2 — CID 106114843

IUPAC2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine
SMILESCOC(CN)CN(C)CC1CCCOC1
InChIInChI=1S/C11H24N2O2/c1-13(8-11(6-12)14-2)7-10-4-3-5-15-9-10/h10-11H,3-9,12H2,1-2H3
InChIKeyDWUIQFPVIKNRJR-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.32
Rot. Bonds6

About 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine

2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine (PubChem CID 106114843) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine.

Molecular Properties

Compound Name2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine
PubChem CID106114843
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine
SMILESCOC(CN)CN(C)CC1CCCOC1
InChIInChI=1S/C11H24N2O2/c1-13(8-11(6-12)14-2)7-10-4-3-5-15-9-10/h10-11H,3-9,12H2,1-2H3
InChIKeyDWUIQFPVIKNRJR-UHFFFAOYSA-N
XLogP0.32
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-N,2-N,3,3-tetramethyl-1-N-(oxan-3-ylmethyl)butane-1,2-diamine
CID 63726325
N'-methyl-N'-(oxan-3-ylmethyl)pentane-1,5-diamine
CID 63725582
3-[[methyl(oxan-3-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 66010095
1-chloro-3-[methyl(oxan-3-ylmethyl)amino]propan-2-ol
CID 112561683
2-N-ethyl-3-methoxy-1-N-methyl-1-N-(oxan-3-ylmethyl)propane-1,2-diamine
CID 107505772
2-N-methyl-2-N-(oxan-3-ylmethyl)butane-1,2-diamine
CID 63725583
N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
CID 175701227
2-N,3,3-trimethyl-2-N-(oxan-3-ylmethyl)butane-1,2-diamine
CID 63725899
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-1-(oxan-3-yl)methanamine
CID 115453877
1-cyclopentyl-N-methyl-N-(oxan-3-ylmethyl)ethane-1,2-diamine
CID 55227963
2-methoxy-N'-methyl-N'-(oxan-4-ylmethyl)butane-1,4-diamine
CID 103152553
N-cyclopropyl-N',2-dimethyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine
CID 63706145

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine?
The IUPAC name of 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine (CID 106114843) is 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine.
What is the SMILES notation for 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine?
The canonical SMILES for 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine is COC(CN)CN(C)CC1CCCOC1.
What is the InChIKey of 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine?
The InChIKey is DWUIQFPVIKNRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-13(8-11(6-12)14-2)7-10-4-3-5-15-9-10/h10-11H,3-9,12H2,1-2H3.
What are the key properties of 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine?
2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine has a molecular weight of 216.32 g/mol, XLogP of 0.32, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N'-methyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine is sourced from PubChem (CID 106114843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).