2-tert-butyl-5-ethylmorpholine

C10H21NO — CID 43366876

IUPAC2-tert-butyl-5-ethylmorpholine
SMILESCCC1COC(C(C)(C)C)CN1
InChIInChI=1S/C10H21NO/c1-5-8-7-12-9(6-11-8)10(2,3)4/h8-9,11H,5-7H2,1-4H3
InChIKeyWEACZWKXANACJJ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.80
Rot. Bonds1

About 2-tert-butyl-5-ethylmorpholine

2-tert-butyl-5-ethylmorpholine (PubChem CID 43366876) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-tert-butyl-5-ethylmorpholine.

Molecular Properties

Compound Name2-tert-butyl-5-ethylmorpholine
PubChem CID43366876
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-tert-butyl-5-ethylmorpholine
SMILESCCC1COC(C(C)(C)C)CN1
InChIInChI=1S/C10H21NO/c1-5-8-7-12-9(6-11-8)10(2,3)4/h8-9,11H,5-7H2,1-4H3
InChIKeyWEACZWKXANACJJ-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-tert-butylphenyl)-5-ethylmorpholine
CID 43366895
(2R)-4-tert-butyl-2-ethylpyrrolidine
CID 122428440
5-tert-butyl-2-(trifluoromethyl)morpholine
CID 127013515
5-ethyl-2-(4-propylphenyl)morpholine
CID 43366877
2,5-diethyl-1-(2-methylbutan-2-yl)piperazine
CID 64931243
3-[(2R,5S)-5-[(4-chlorophenyl)methyl]morpholin-2-yl]pentan-3-ol
CID 155765794
3-tert-butyldioxetane
CID 56995815
2-tert-butyl-5-ethyl-1-(oxolan-3-yl)piperazine
CID 64842925
2-(3-chloro-4-fluorophenyl)-5-ethylmorpholine
CID 43366861
(2R,5S)-2-ethyl-5-methylpiperazine
CID 56973373
2-tert-butyl-5,5-dimethylmorpholine
CID 43366948
(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine
CID 124508872

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-ethylmorpholine?
The IUPAC name of 2-tert-butyl-5-ethylmorpholine (CID 43366876) is 2-tert-butyl-5-ethylmorpholine.
What is the SMILES notation for 2-tert-butyl-5-ethylmorpholine?
The canonical SMILES for 2-tert-butyl-5-ethylmorpholine is CCC1COC(C(C)(C)C)CN1.
What is the InChIKey of 2-tert-butyl-5-ethylmorpholine?
The InChIKey is WEACZWKXANACJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-8-7-12-9(6-11-8)10(2,3)4/h8-9,11H,5-7H2,1-4H3.
What are the key properties of 2-tert-butyl-5-ethylmorpholine?
2-tert-butyl-5-ethylmorpholine has a molecular weight of 171.28 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-ethylmorpholine is sourced from PubChem (CID 43366876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).