N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine

C17H28N2O — CID 62435983

IUPACN-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine
SMILESCCNCc1ccc(CN2CC(C)OC(C)(C)C2)cc1
InChIInChI=1S/C17H28N2O/c1-5-18-10-15-6-8-16(9-7-15)12-19-11-14(2)20-17(3,4)13-19/h6-9,14,18H,5,10-13H2,1-4H3
InChIKeyRCZJCHPOTQNZQT-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.80
Rot. Bonds5

About N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine

N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine (PubChem CID 62435983) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine
PubChem CID62435983
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine
SMILESCCNCc1ccc(CN2CC(C)OC(C)(C)C2)cc1
InChIInChI=1S/C17H28N2O/c1-5-18-10-15-6-8-16(9-7-15)12-19-11-14(2)20-17(3,4)13-19/h6-9,14,18H,5,10-13H2,1-4H3
InChIKeyRCZJCHPOTQNZQT-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine with MolForge

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Related Compounds

N-[[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
CID 62435098
N-[[4-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]phenyl]methyl]ethanamine
CID 104960940
trimethyl-[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]silane
CID 103438391
N-[[3-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-2-yl]methyl]ethanamine
CID 55072759
N-[[5-methyl-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]thiophen-2-yl]methyl]ethanamine
CID 80728050
N-methyl-1-[3-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methanamine
CID 62436863
N-[[4-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]phenyl]methyl]propan-1-amine
CID 104960962
2,6-dimethoxy-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenol
CID 78976743
[3-chloro-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methanamine
CID 102662894
N-ethyl-3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridin-2-amine
CID 55075566
3-[(2,2,6-trimethylmorpholin-4-yl)methyl]benzonitrile
CID 47430318
N-[[6-(2,2,6-trimethylmorpholin-4-yl)pyridazin-3-yl]methyl]ethanamine
CID 62294833

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine?
The IUPAC name of N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine (CID 62435983) is N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine.
What is the SMILES notation for N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine?
The canonical SMILES for N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine is CCNCc1ccc(CN2CC(C)OC(C)(C)C2)cc1.
What is the InChIKey of N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine?
The InChIKey is RCZJCHPOTQNZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-18-10-15-6-8-16(9-7-15)12-19-11-14(2)20-17(3,4)13-19/h6-9,14,18H,5,10-13H2,1-4H3.
What are the key properties of N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine?
N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine has a molecular weight of 276.42 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2,2,6-trimethylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine is sourced from PubChem (CID 62435983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).