N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine

C16H32N2O — CID 102746059

IUPACN-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine
SMILESCCCNCC1CCC1N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C16H32N2O/c1-6-9-17-10-13-7-8-14(13)18-11-15(2,3)19-16(4,5)12-18/h13-14,17H,6-12H2,1-5H3
InChIKeyKJBYZDLOHAIETE-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.65
Rot. Bonds5

About N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine

N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine (PubChem CID 102746059) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine
PubChem CID102746059
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine
SMILESCCCNCC1CCC1N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C16H32N2O/c1-6-9-17-10-13-7-8-14(13)18-11-15(2,3)19-16(4,5)12-18/h13-14,17H,6-12H2,1-5H3
InChIKeyKJBYZDLOHAIETE-UHFFFAOYSA-N
XLogP2.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine with MolForge

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Related Compounds

N-[[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclobutyl]methyl]propan-1-amine
CID 81005499
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CID 80997839
N-[[2-(4-butan-2-ylpiperazin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 80999580
N-[[2-(3-ethylpiperidin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 80998879
N-[[(1R,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]propan-1-amine
CID 99805392
N-[[2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)cyclobutyl]methyl]propan-1-amine
CID 81005492
N-[[2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)cyclobutyl]methyl]propan-1-amine
CID 82753410
N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine
CID 80999244
N-[[2-(1,2,4-triazol-1-yl)cyclobutyl]methyl]propan-1-amine
CID 81004727
N-[[2-(2,3-dimethylpiperidin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 80996996
N-[[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]methyl]propan-1-amine
CID 114624087
N-[[2-(2-propylpiperidin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 83061780

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine?
The IUPAC name of N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine (CID 102746059) is N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine.
What is the SMILES notation for N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine?
The canonical SMILES for N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine is CCCNCC1CCC1N1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine?
The InChIKey is KJBYZDLOHAIETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-6-9-17-10-13-7-8-14(13)18-11-15(2,3)19-16(4,5)12-18/h13-14,17H,6-12H2,1-5H3.
What are the key properties of N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine?
N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,2,6,6-tetramethylmorpholin-4-yl)cyclobutyl]methyl]propan-1-amine is sourced from PubChem (CID 102746059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).