N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine

C14H28N2O2 — CID 143952966

IUPACN,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine
SMILESCN(C)C1CCOCC1CN(C)C1CCOCC1
InChIInChI=1S/C14H28N2O2/c1-15(2)14-6-9-18-11-12(14)10-16(3)13-4-7-17-8-5-13/h12-14H,4-11H2,1-3H3
InChIKeyFKNJSZDBPDCTHR-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.06
Rot. Bonds4

About N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine

N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine (PubChem CID 143952966) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine
PubChem CID143952966
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine
SMILESCN(C)C1CCOCC1CN(C)C1CCOCC1
InChIInChI=1S/C14H28N2O2/c1-15(2)14-6-9-18-11-12(14)10-16(3)13-4-7-17-8-5-13/h12-14H,4-11H2,1-3H3
InChIKeyFKNJSZDBPDCTHR-UHFFFAOYSA-N
XLogP1.06
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine?
The IUPAC name of N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine (CID 143952966) is N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine.
What is the SMILES notation for N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine?
The canonical SMILES for N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine is CN(C)C1CCOCC1CN(C)C1CCOCC1.
What is the InChIKey of N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine?
The InChIKey is FKNJSZDBPDCTHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-15(2)14-6-9-18-11-12(14)10-16(3)13-4-7-17-8-5-13/h12-14H,4-11H2,1-3H3.
What are the key properties of N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine?
N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine has a molecular weight of 256.39 g/mol, XLogP of 1.06, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine is sourced from PubChem (CID 143952966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).