2-(4-tert-butylphenyl)-5-ethylmorpholine

C16H25NO — CID 43366895

IUPAC2-(4-tert-butylphenyl)-5-ethylmorpholine
SMILESCCC1COC(c2ccc(C(C)(C)C)cc2)CN1
InChIInChI=1S/C16H25NO/c1-5-14-11-18-15(10-17-14)12-6-8-13(9-7-12)16(2,3)4/h6-9,14-15,17H,5,10-11H2,1-4H3
InChIKeyLTDLWWRJBCZTIO-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.42
Rot. Bonds2

About 2-(4-tert-butylphenyl)-5-ethylmorpholine

2-(4-tert-butylphenyl)-5-ethylmorpholine (PubChem CID 43366895) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-5-ethylmorpholine.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-5-ethylmorpholine
PubChem CID43366895
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name2-(4-tert-butylphenyl)-5-ethylmorpholine
SMILESCCC1COC(c2ccc(C(C)(C)C)cc2)CN1
InChIInChI=1S/C16H25NO/c1-5-14-11-18-15(10-17-14)12-6-8-13(9-7-12)16(2,3)4/h6-9,14-15,17H,5,10-11H2,1-4H3
InChIKeyLTDLWWRJBCZTIO-UHFFFAOYSA-N
XLogP3.42
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-2-(4-propylphenyl)morpholine
CID 43366877
2-(3-chloro-4-fluorophenyl)-5-ethylmorpholine
CID 43366861
5-(2-methylpropyl)-2-[4-(trifluoromethyl)phenyl]morpholine
CID 61250695
(6-phenylmorpholin-3-yl)methanol
CID 84733084
5-methyl-2-[4-(trifluoromethyl)phenyl]morpholine
CID 43367137
2-tert-butyl-5-ethylmorpholine
CID 43366876
5-(2-methylpropyl)-2-[4-(trifluoromethoxy)phenyl]morpholine
CID 61250917
8-(4-tert-butylphenyl)-7-oxa-10-azaspiro[4.6]undecane
CID 115361978
5-(4-tert-butylphenyl)-2-methylmorpholine
CID 82290188
3-(4-tert-butylphenyl)-5-ethyl-1,2,4-trioxolane
CID 15709236
(2R,5S)-2-(4-fluorophenyl)-5-methylmorpholine;(5S)-2-(4-fluorophenyl)-5-methylmorpholine
CID 158378174
4-[(5R)-5-ethylmorpholin-2-yl]-2-fluoro-6-methoxybenzonitrile
CID 130439228

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-5-ethylmorpholine?
The IUPAC name of 2-(4-tert-butylphenyl)-5-ethylmorpholine (CID 43366895) is 2-(4-tert-butylphenyl)-5-ethylmorpholine.
What is the SMILES notation for 2-(4-tert-butylphenyl)-5-ethylmorpholine?
The canonical SMILES for 2-(4-tert-butylphenyl)-5-ethylmorpholine is CCC1COC(c2ccc(C(C)(C)C)cc2)CN1.
What is the InChIKey of 2-(4-tert-butylphenyl)-5-ethylmorpholine?
The InChIKey is LTDLWWRJBCZTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-5-14-11-18-15(10-17-14)12-6-8-13(9-7-12)16(2,3)4/h6-9,14-15,17H,5,10-11H2,1-4H3.
What are the key properties of 2-(4-tert-butylphenyl)-5-ethylmorpholine?
2-(4-tert-butylphenyl)-5-ethylmorpholine has a molecular weight of 247.38 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-5-ethylmorpholine is sourced from PubChem (CID 43366895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).