[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine

C15H28N2O — CID 66392860

IUPAC[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
SMILESCCC1CCCC(CN)(N2CC3CCC(C2)O3)C1
InChIInChI=1S/C15H28N2O/c1-2-12-4-3-7-15(8-12,11-16)17-9-13-5-6-14(10-17)18-13/h12-14H,2-11,16H2,1H3
InChIKeyMPNAORYPMNPYBX-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.15
Rot. Bonds3

About [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine

[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine (PubChem CID 66392860) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
PubChem CID66392860
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
SMILESCCC1CCCC(CN)(N2CC3CCC(C2)O3)C1
InChIInChI=1S/C15H28N2O/c1-2-12-4-3-7-15(8-12,11-16)17-9-13-5-6-14(10-17)18-13/h12-14H,2-11,16H2,1H3
InChIKeyMPNAORYPMNPYBX-UHFFFAOYSA-N
XLogP2.15
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine with MolForge

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Related Compounds

[1-(3,4-dimethylpyrrolidin-1-yl)-3-ethylcyclopentyl]methanamine
CID 79188486
[4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine
CID 66392846
[1-(3-azabicyclo[3.3.1]nonan-3-yl)-3-ethylcyclopentyl]methanamine
CID 114196334
[4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)oxepan-4-yl]methanamine
CID 66392857
[3-ethyl-1-(3,4,5-trimethylpiperazin-1-yl)cyclopentyl]methanamine
CID 114537628
[1-(3-ethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429133
[3-ethoxy-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclobutyl]methanamine
CID 106822190
[1-(3,4-dimethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429099
[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 64625427
[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
CID 43584374
[1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-propylcycloheptyl]methanamine
CID 104958066
[1-(3-ethylpyrrolidin-1-yl)-3-methoxycyclohexyl]methanamine
CID 106872732

Frequently Asked Questions

What is the IUPAC name of [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
The IUPAC name of [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine (CID 66392860) is [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine.
What is the SMILES notation for [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
The canonical SMILES for [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine is CCC1CCCC(CN)(N2CC3CCC(C2)O3)C1.
What is the InChIKey of [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
The InChIKey is MPNAORYPMNPYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-12-4-3-7-15(8-12,11-16)17-9-13-5-6-14(10-17)18-13/h12-14H,2-11,16H2,1H3.
What are the key properties of [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine?
[3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine has a molecular weight of 252.40 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclohexyl]methanamine is sourced from PubChem (CID 66392860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).