N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine

C17H28N2O — CID 62431897

IUPACN-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine
SMILESCC(C)NCC(c1ccccc1)N1CC(C)OCC1C
InChIInChI=1S/C17H28N2O/c1-13(2)18-10-17(16-8-6-5-7-9-16)19-11-15(4)20-12-14(19)3/h5-9,13-15,17-18H,10-12H2,1-4H3
InChIKeyKBFDKQKZOOXZLX-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.83
Rot. Bonds5

About N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine

N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine (PubChem CID 62431897) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine
PubChem CID62431897
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine
SMILESCC(C)NCC(c1ccccc1)N1CC(C)OCC1C
InChIInChI=1S/C17H28N2O/c1-13(2)18-10-17(16-8-6-5-7-9-16)19-11-15(4)20-12-14(19)3/h5-9,13-15,17-18H,10-12H2,1-4H3
InChIKeyKBFDKQKZOOXZLX-UHFFFAOYSA-N
XLogP2.83
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 ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,4-dimethylpyrrolidin-1-yl)-2-phenylethyl]propan-2-amine
CID 79183761
N,N,4-trimethyl-1-[1-phenyl-2-(propan-2-ylamino)ethyl]pyrrolidin-3-amine
CID 81463881
N-[2-(3,4-dimethoxypyrrolidin-1-yl)-2-phenylethyl]propan-2-amine
CID 103539932
ethyl 2-(2,5-dimethylmorpholin-4-yl)-2-phenylacetate
CID 106677030
2-(2,5-dimethylmorpholin-4-yl)-1-phenylpropan-1-one
CID 43796467
3-(5-ethyl-2-methylmorpholin-4-yl)-3-phenylpropanethioamide
CID 62780102
2-[2-(difluoromethoxy)phenyl]-2-(2,5-dimethylmorpholin-4-yl)ethanamine
CID 43544317
2-(2,5-dimethylmorpholin-4-yl)-1-phenylethanamine
CID 43544546
N-methyl-2-(2-methyl-1,4-oxazepan-4-yl)-2-phenylethanamine
CID 62974266
2-(2,5-dimethylmorpholin-4-yl)-2-(2-ethoxyphenyl)ethanamine
CID 43544351
2-(2,5-dimethylmorpholin-4-yl)-2-(3,4-dimethylphenyl)ethanamine
CID 43753499
[5-methyl-4-(1-phenylethyl)morpholin-2-yl]methanamine
CID 81218045

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine?
The IUPAC name of N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine (CID 62431897) is N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine.
What is the SMILES notation for N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine?
The canonical SMILES for N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine is CC(C)NCC(c1ccccc1)N1CC(C)OCC1C.
What is the InChIKey of N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine?
The InChIKey is KBFDKQKZOOXZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-13(2)18-10-17(16-8-6-5-7-9-16)19-11-15(4)20-12-14(19)3/h5-9,13-15,17-18H,10-12H2,1-4H3.
What are the key properties of N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine?
N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine has a molecular weight of 276.42 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dimethylmorpholin-4-yl)-2-phenylethyl]propan-2-amine is sourced from PubChem (CID 62431897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).