N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine

C16H28N2O2 — CID 102743422

IUPACN-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
SMILESCCNCc1ccc(CN2CC(C)(C)OC(C)(C)C2)o1
InChIInChI=1S/C16H28N2O2/c1-6-17-9-13-7-8-14(19-13)10-18-11-15(2,3)20-16(4,5)12-18/h7-8,17H,6,9-12H2,1-5H3
InChIKeyIFNQJFPJIGXQQQ-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.78
Rot. Bonds5

About N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine

N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine (PubChem CID 102743422) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
PubChem CID102743422
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
SMILESCCNCc1ccc(CN2CC(C)(C)OC(C)(C)C2)o1
InChIInChI=1S/C16H28N2O2/c1-6-17-9-13-7-8-14(19-13)10-18-11-15(2,3)20-16(4,5)12-18/h7-8,17H,6,9-12H2,1-5H3
InChIKeyIFNQJFPJIGXQQQ-UHFFFAOYSA-N
XLogP2.78
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine (CID 102743422) is N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine is CCNCc1ccc(CN2CC(C)(C)OC(C)(C)C2)o1.
What is the InChIKey of N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine?
The InChIKey is IFNQJFPJIGXQQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-6-17-9-13-7-8-14(19-13)10-18-11-15(2,3)20-16(4,5)12-18/h7-8,17H,6,9-12H2,1-5H3.
What are the key properties of N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine?
N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine has a molecular weight of 280.41 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine is sourced from PubChem (CID 102743422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).