(5R)-4-tert-butyl-2,2,5-trimethylmorpholine

C11H23NO — CID 168820806

IUPAC(5R)-4-tert-butyl-2,2,5-trimethylmorpholine
SMILESC[C@@H]1COC(C)(C)CN1C(C)(C)C
InChIInChI=1S/C11H23NO/c1-9-7-13-11(5,6)8-12(9)10(2,3)4/h9H,7-8H2,1-6H3/t9-/m1/s1
InChIKeyTZYDPXUQSCWJQA-SECBINFHSA-N
MW185.31 g/mol
LogP2.28
Rot. Bonds

About (5R)-4-tert-butyl-2,2,5-trimethylmorpholine

(5R)-4-tert-butyl-2,2,5-trimethylmorpholine (PubChem CID 168820806) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is (5R)-4-tert-butyl-2,2,5-trimethylmorpholine.

Molecular Properties

Compound Name(5R)-4-tert-butyl-2,2,5-trimethylmorpholine
PubChem CID168820806
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name(5R)-4-tert-butyl-2,2,5-trimethylmorpholine
SMILESC[C@@H]1COC(C)(C)CN1C(C)(C)C
InChIInChI=1S/C11H23NO/c1-9-7-13-11(5,6)8-12(9)10(2,3)4/h9H,7-8H2,1-6H3/t9-/m1/s1
InChIKeyTZYDPXUQSCWJQA-SECBINFHSA-N
XLogP2.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-4-tert-butyl-2,2,5-trimethylmorpholine?
The IUPAC name of (5R)-4-tert-butyl-2,2,5-trimethylmorpholine (CID 168820806) is (5R)-4-tert-butyl-2,2,5-trimethylmorpholine.
What is the SMILES notation for (5R)-4-tert-butyl-2,2,5-trimethylmorpholine?
The canonical SMILES for (5R)-4-tert-butyl-2,2,5-trimethylmorpholine is C[C@@H]1COC(C)(C)CN1C(C)(C)C.
What is the InChIKey of (5R)-4-tert-butyl-2,2,5-trimethylmorpholine?
The InChIKey is TZYDPXUQSCWJQA-SECBINFHSA-N. The full InChI is InChI=1S/C11H23NO/c1-9-7-13-11(5,6)8-12(9)10(2,3)4/h9H,7-8H2,1-6H3/t9-/m1/s1.
What are the key properties of (5R)-4-tert-butyl-2,2,5-trimethylmorpholine?
(5R)-4-tert-butyl-2,2,5-trimethylmorpholine has a molecular weight of 185.31 g/mol, XLogP of 2.28, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-4-tert-butyl-2,2,5-trimethylmorpholine is sourced from PubChem (CID 168820806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).