N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine

C13H24N2O2 — CID 113448314

IUPACN-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine
SMILESCNC(CN1CC2CCC(C1)O2)C1CCOC1
InChIInChI=1S/C13H24N2O2/c1-14-13(10-4-5-16-9-10)8-15-6-11-2-3-12(7-15)17-11/h10-14H,2-9H2,1H3
InChIKeyABWSBCCKCFZYGX-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.47
Rot. Bonds4

About N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine

N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine (PubChem CID 113448314) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine
PubChem CID113448314
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine
SMILESCNC(CN1CC2CCC(C1)O2)C1CCOC1
InChIInChI=1S/C13H24N2O2/c1-14-13(10-4-5-16-9-10)8-15-6-11-2-3-12(7-15)17-11/h10-14H,2-9H2,1H3
InChIKeyABWSBCCKCFZYGX-UHFFFAOYSA-N
XLogP0.47
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine with MolForge

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Related Compounds

N-methyl-1-(oxolan-3-yl)-2-(4-propan-2-ylazepan-1-yl)ethanamine
CID 104746479
N-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-2-amine
CID 66391107
2-(3-ethylmorpholin-4-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
CID 113448072
N-methyl-2-(2-methylpiperidin-1-yl)-1-(oxolan-3-yl)ethanamine
CID 104744306
N-methyl-2-methylsulfanyl-1-(oxolan-3-yl)ethanamine
CID 63564188
N-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propan-2-amine
CID 66391503
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-methyl-1-(oxolan-3-yl)ethanamine
CID 102725921
2-(2-ethylpiperidin-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
CID 104744647
2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
CID 104746222
1-ethyl-4-[2-(methylamino)-2-(oxolan-3-yl)ethyl]piperazine-2,5-dione
CID 104747969
3-ethyl-N-methyl-1-(oxolan-3-yl)pentan-1-amine
CID 82923243
N-methyl-1-(oxolan-3-yl)pent-3-yn-1-amine
CID 65330413

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine?
The IUPAC name of N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine (CID 113448314) is N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine is CNC(CN1CC2CCC(C1)O2)C1CCOC1.
What is the InChIKey of N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine?
The InChIKey is ABWSBCCKCFZYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-14-13(10-4-5-16-9-10)8-15-6-11-2-3-12(7-15)17-11/h10-14H,2-9H2,1H3.
What are the key properties of N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine?
N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine has a molecular weight of 240.35 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 113448314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).