3-[4-(2-methylpropoxy)phenyl]morpholine

C14H21NO2 — CID 82291237

IUPAC3-[4-(2-methylpropoxy)phenyl]morpholine
SMILESCC(C)COc1ccc(C2COCCN2)cc1
InChIInChI=1S/C14H21NO2/c1-11(2)9-17-13-5-3-12(4-6-13)14-10-16-8-7-15-14/h3-6,11,14-15H,7-10H2,1-2H3
InChIKeyGYYDFWSFDGFIEU-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.38
Rot. Bonds4

About 3-[4-(2-methylpropoxy)phenyl]morpholine

3-[4-(2-methylpropoxy)phenyl]morpholine (PubChem CID 82291237) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 3-[4-(2-methylpropoxy)phenyl]morpholine.

Molecular Properties

Compound Name3-[4-(2-methylpropoxy)phenyl]morpholine
PubChem CID82291237
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name3-[4-(2-methylpropoxy)phenyl]morpholine
SMILESCC(C)COc1ccc(C2COCCN2)cc1
InChIInChI=1S/C14H21NO2/c1-11(2)9-17-13-5-3-12(4-6-13)14-10-16-8-7-15-14/h3-6,11,14-15H,7-10H2,1-2H3
InChIKeyGYYDFWSFDGFIEU-UHFFFAOYSA-N
XLogP2.38
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(2-methylpropoxy)phenyl]piperazine
CID 82290919
2-[4-(2-methylpropoxy)phenyl]pyrrolidine
CID 77131626
(3S)-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]morpholine
CID 95451553
(3S)-3-(4-fluorophenyl)morpholine
CID 22860769
3-[4-(trifluoromethoxy)phenyl]morpholine;hydrochloride
CID 154810211
4-[(3R)-morpholin-3-yl]benzenethiol
CID 130654195
(3S)-3-(4-iodophenyl)morpholine
CID 130690924
3-(4-methoxy-3-propan-2-ylphenyl)morpholine
CID 82083415
(3S)-3-(4-methylsulfonylphenyl)morpholine;hydrochloride
CID 171192994
(3R)-3-(3,4-dimethoxyphenyl)morpholine
CID 42183336
3-(6-methylnaphthalen-2-yl)morpholine
CID 116963155
3-(4-ethoxy-3-fluorophenyl)morpholine
CID 82287553

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-methylpropoxy)phenyl]morpholine?
The IUPAC name of 3-[4-(2-methylpropoxy)phenyl]morpholine (CID 82291237) is 3-[4-(2-methylpropoxy)phenyl]morpholine.
What is the SMILES notation for 3-[4-(2-methylpropoxy)phenyl]morpholine?
The canonical SMILES for 3-[4-(2-methylpropoxy)phenyl]morpholine is CC(C)COc1ccc(C2COCCN2)cc1.
What is the InChIKey of 3-[4-(2-methylpropoxy)phenyl]morpholine?
The InChIKey is GYYDFWSFDGFIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-11(2)9-17-13-5-3-12(4-6-13)14-10-16-8-7-15-14/h3-6,11,14-15H,7-10H2,1-2H3.
What are the key properties of 3-[4-(2-methylpropoxy)phenyl]morpholine?
3-[4-(2-methylpropoxy)phenyl]morpholine has a molecular weight of 235.33 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-methylpropoxy)phenyl]morpholine is sourced from PubChem (CID 82291237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).