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

C15H24N2O — CID 112681201

IUPAC2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
SMILESCNC(Cc1ccco1)C1CC2CCC(C1)N2C
InChIInChI=1S/C15H24N2O/c1-16-15(10-14-4-3-7-18-14)11-8-12-5-6-13(9-11)17(12)2/h3-4,7,11-13,15-16H,5-6,8-10H2,1-2H3
InChIKeyWYDGQZVTCBXWLD-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.28
Rot. Bonds4

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

2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine (PubChem CID 112681201) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
PubChem CID112681201
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
SMILESCNC(Cc1ccco1)C1CC2CCC(C1)N2C
InChIInChI=1S/C15H24N2O/c1-16-15(10-14-4-3-7-18-14)11-8-12-5-6-13(9-11)17(12)2/h3-4,7,11-13,15-16H,5-6,8-10H2,1-2H3
InChIKeyWYDGQZVTCBXWLD-UHFFFAOYSA-N
XLogP2.28
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
The IUPAC name of 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine (CID 112681201) is 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine.
What is the SMILES notation for 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
The canonical SMILES for 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine is CNC(Cc1ccco1)C1CC2CCC(C1)N2C.
What is the InChIKey of 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
The InChIKey is WYDGQZVTCBXWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-16-15(10-14-4-3-7-18-14)11-8-12-5-6-13(9-11)17(12)2/h3-4,7,11-13,15-16H,5-6,8-10H2,1-2H3.
What are the key properties of 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine has a molecular weight of 248.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine is sourced from PubChem (CID 112681201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).