3-(diethylaminomethyl)oxan-4-amine

C10H22N2O — CID 83619174

IUPAC3-(diethylaminomethyl)oxan-4-amine
SMILESCCN(CC)CC1COCCC1N
InChIInChI=1S/C10H22N2O/c1-3-12(4-2)7-9-8-13-6-5-10(9)11/h9-10H,3-8,11H2,1-2H3
InChIKeyNCQHCHCWYZLCBV-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.69
Rot. Bonds4

About 3-(diethylaminomethyl)oxan-4-amine

3-(diethylaminomethyl)oxan-4-amine (PubChem CID 83619174) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-(diethylaminomethyl)oxan-4-amine.

Molecular Properties

Compound Name3-(diethylaminomethyl)oxan-4-amine
PubChem CID83619174
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-(diethylaminomethyl)oxan-4-amine
SMILESCCN(CC)CC1COCCC1N
InChIInChI=1S/C10H22N2O/c1-3-12(4-2)7-9-8-13-6-5-10(9)11/h9-10H,3-8,11H2,1-2H3
InChIKeyNCQHCHCWYZLCBV-UHFFFAOYSA-N
XLogP0.69
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[(4-aminooxan-3-yl)methyl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 103061096
3-N-ethyl-3-N-methyloxane-3,4-diamine
CID 43608817
2-[(4-aminooxan-3-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
CID 107486880
2-(diethylaminomethyl)cycloheptan-1-amine
CID 62616063
3-[[methyl(2-methylsulfanylethyl)amino]methyl]oxan-4-amine
CID 103060776
3-[[ethyl(naphthalen-1-yl)amino]methyl]oxan-4-amine
CID 103058489
4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
CID 66236322
4-[(4-aminooxan-3-yl)methyl-methylamino]butan-2-ol
CID 103060860
3-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]oxan-4-amine
CID 106469054
N-[[(1R,2R)-2-(diethylaminomethyl)cyclopentyl]methyl]-N-ethylethanamine
CID 10538046
3-(2-propoxyethyl)oxan-4-amine
CID 106469000
3-[(dipropylamino)methyl]oxan-4-ol
CID 103061158

Frequently Asked Questions

What is the IUPAC name of 3-(diethylaminomethyl)oxan-4-amine?
The IUPAC name of 3-(diethylaminomethyl)oxan-4-amine (CID 83619174) is 3-(diethylaminomethyl)oxan-4-amine.
What is the SMILES notation for 3-(diethylaminomethyl)oxan-4-amine?
The canonical SMILES for 3-(diethylaminomethyl)oxan-4-amine is CCN(CC)CC1COCCC1N.
What is the InChIKey of 3-(diethylaminomethyl)oxan-4-amine?
The InChIKey is NCQHCHCWYZLCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-3-12(4-2)7-9-8-13-6-5-10(9)11/h9-10H,3-8,11H2,1-2H3.
What are the key properties of 3-(diethylaminomethyl)oxan-4-amine?
3-(diethylaminomethyl)oxan-4-amine has a molecular weight of 186.30 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylaminomethyl)oxan-4-amine is sourced from PubChem (CID 83619174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).