4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine

C17H27NO4 — CID 20871911

IUPAC4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine
SMILESCOc1ccc(C(C)C)c(OCCN2CCOCC2)c1OC
InChIInChI=1S/C17H27NO4/c1-13(2)14-5-6-15(19-3)17(20-4)16(14)22-12-9-18-7-10-21-11-8-18/h5-6,13H,7-12H2,1-4H3
InChIKeyQFYVVYATBDRKTP-UHFFFAOYSA-N
MW309.41 g/mol
LogP2.54
Rot. Bonds7

About 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine

4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine (PubChem CID 20871911) has the molecular formula C17H27NO4 and a molecular weight of 309.41 g/mol. Its IUPAC name is 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine
PubChem CID20871911
Molecular FormulaC17H27NO4
Molecular Weight309.41 g/mol
Exact Mass309.19
IUPAC Name4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine
SMILESCOc1ccc(C(C)C)c(OCCN2CCOCC2)c1OC
InChIInChI=1S/C17H27NO4/c1-13(2)14-5-6-15(19-3)17(20-4)16(14)22-12-9-18-7-10-21-11-8-18/h5-6,13H,7-12H2,1-4H3
InChIKeyQFYVVYATBDRKTP-UHFFFAOYSA-N
XLogP2.54
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-2-(2-morpholin-4-ylethoxy)benzonitrile
CID 22685973
[3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)phenyl]methanol
CID 43516741
4-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 3386987
4-[2-(5-phenyl-2-propan-2-ylphenoxy)ethyl]morpholine
CID 146386321
4-[(2,3,4-trimethoxyphenyl)methyl]morpholine
CID 782614
4-[2-(2,6-dimethyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 20871910
4-[2-[2-methoxy-6-[(4-methoxy-3-methylphenyl)methyl]phenoxy]ethyl]morpholine
CID 137342586
4-methoxy-3-(2-morpholin-4-ylethoxy)benzaldehyde
CID 3251033
methyl 3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)benzoate
CID 58976806
4-[3-[3-methoxy-2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]propyl]morpholine
CID 170870699
2-[[3-methoxy-2-(2-morpholin-4-ylethoxy)phenyl]methylideneamino]guanidine
CID 168592427
(1S)-1-[2-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 78936484

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine (CID 20871911) is 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine is COc1ccc(C(C)C)c(OCCN2CCOCC2)c1OC.
What is the InChIKey of 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine?
The InChIKey is QFYVVYATBDRKTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO4/c1-13(2)14-5-6-15(19-3)17(20-4)16(14)22-12-9-18-7-10-21-11-8-18/h5-6,13H,7-12H2,1-4H3.
What are the key properties of 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine?
4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine has a molecular weight of 309.41 g/mol, XLogP of 2.54, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,3-dimethoxy-6-propan-2-ylphenoxy)ethyl]morpholine is sourced from PubChem (CID 20871911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).