2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine

C18H30N2O — CID 43592601

IUPAC2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine
SMILESCC1(C)CN(C(CN)c2ccc(C(C)(C)C)cc2)CCO1
InChIInChI=1S/C18H30N2O/c1-17(2,3)15-8-6-14(7-9-15)16(12-19)20-10-11-21-18(4,5)13-20/h6-9,16H,10-13,19H2,1-5H3
InChIKeyGEHFKTHIUYLPQX-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.09
Rot. Bonds3

About 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine

2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine (PubChem CID 43592601) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine
PubChem CID43592601
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine
SMILESCC1(C)CN(C(CN)c2ccc(C(C)(C)C)cc2)CCO1
InChIInChI=1S/C18H30N2O/c1-17(2,3)15-8-6-14(7-9-15)16(12-19)20-10-11-21-18(4,5)13-20/h6-9,16H,10-13,19H2,1-5H3
InChIKeyGEHFKTHIUYLPQX-UHFFFAOYSA-N
XLogP3.09
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,2-dimethylmorpholin-4-yl)-2-(4-ethoxyphenyl)ethanamine
CID 43592587
2-(2,2-dimethylmorpholin-4-yl)-2-(4-fluoro-3-methylphenyl)ethanamine
CID 62121310
2-(4-tert-butylphenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 16642740
2-[2-(4-chlorophenyl)-2-(2,2-dimethylmorpholin-4-yl)ethyl]guanidine;hydroiodide
CID 110936786
2-(2,4-dimethoxyphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine
CID 43592595
2-(4-tert-butylphenyl)-2-(3,5-dimethylpiperidin-1-yl)ethanamine
CID 43081261
2-(4-chlorophenyl)-2-(2,2-dimethylmorpholin-4-yl)-N-(pyridin-4-ylmethyl)ethanamine
CID 119114926
1-(2,2-dimethylmorpholin-4-yl)-1-(4-methylphenyl)propan-2-amine
CID 55016329
1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine
CID 55015046
1-[2-amino-1-(4-methylphenyl)ethyl]-3-methylpyrrolidin-3-ol
CID 103355396
2-[2-(4-chlorophenyl)-2-(2,2-dimethylmorpholin-4-yl)ethyl]-1-(2-methylprop-2-enyl)guanidine
CID 136859919
(2S)-2-(4-chlorophenyl)-2-(2,2-dimethylmorpholin-4-yl)-N-[(3-methylimidazol-4-yl)methyl]ethanamine
CID 124699693

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine?
The IUPAC name of 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine (CID 43592601) is 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine.
What is the SMILES notation for 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine?
The canonical SMILES for 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine is CC1(C)CN(C(CN)c2ccc(C(C)(C)C)cc2)CCO1.
What is the InChIKey of 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine?
The InChIKey is GEHFKTHIUYLPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-17(2,3)15-8-6-14(7-9-15)16(12-19)20-10-11-21-18(4,5)13-20/h6-9,16H,10-13,19H2,1-5H3.
What are the key properties of 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine?
2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine has a molecular weight of 290.45 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanamine is sourced from PubChem (CID 43592601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).