4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine

C15H23NO2 — CID 868362

IUPAC4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine
SMILESCc1cc(C)c(C)c(OCCN2CCOCC2)c1
InChIInChI=1S/C15H23NO2/c1-12-10-13(2)14(3)15(11-12)18-9-6-16-4-7-17-8-5-16/h10-11H,4-9H2,1-3H3
InChIKeyHGGSUTCZSZMTLJ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.32
Rot. Bonds4

About 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine

4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine (PubChem CID 868362) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine
PubChem CID868362
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine
SMILESCc1cc(C)c(C)c(OCCN2CCOCC2)c1
InChIInChI=1S/C15H23NO2/c1-12-10-13(2)14(3)15(11-12)18-9-6-16-4-7-17-8-5-16/h10-11H,4-9H2,1-3H3
InChIKeyHGGSUTCZSZMTLJ-UHFFFAOYSA-N
XLogP2.32
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(2,3,5-trimethylphenoxy)propyl]piperidine
CID 2057820
4-[2-(2-chloro-4,6-dimethylphenoxy)ethyl]morpholine
CID 869403
N-(1,3-dimethoxypropan-2-yl)-5-[2,4-dimethyl-6-(2-morpholin-4-ylethoxy)phenyl]-3,6-dimethylpyrazin-2-amine
CID 91498775
1-ethyl-4-[4-(2,3,5-trimethylphenoxy)butyl]piperazine
CID 2216167
ethane;4-[2-(2-methylphenoxy)ethyl]morpholine
CID 144752549
4-[4-(2,5-dimethylphenoxy)butyl]morpholine
CID 2245898
4-[2-(2,3-difluoro-4-methylphenoxy)ethyl]morpholine
CID 123286014
[5-methyl-2-(2-morpholin-4-ylethoxy)phenyl]methanol
CID 63325103
4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine
CID 872206
N-methyl-1-[5-methyl-2-(2-morpholin-4-ylethoxy)phenyl]methanamine
CID 63323660
trifluoro-[5-methyl-2-(2-morpholin-4-ylethoxy)phenyl]boranuide
CID 63676214
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine (CID 868362) is 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine is Cc1cc(C)c(C)c(OCCN2CCOCC2)c1.
What is the InChIKey of 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine?
The InChIKey is HGGSUTCZSZMTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-12-10-13(2)14(3)15(11-12)18-9-6-16-4-7-17-8-5-16/h10-11H,4-9H2,1-3H3.
What are the key properties of 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine?
4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine has a molecular weight of 249.35 g/mol, XLogP of 2.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,3,5-trimethylphenoxy)ethyl]morpholine is sourced from PubChem (CID 868362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).