2-(3-methoxy-2,4-dimethylphenyl)morpholine

C13H19NO2 — CID 117316054

IUPAC2-(3-methoxy-2,4-dimethylphenyl)morpholine
SMILESCOc1c(C)ccc(C2CNCCO2)c1C
InChIInChI=1S/C13H19NO2/c1-9-4-5-11(10(2)13(9)15-3)12-8-14-6-7-16-12/h4-5,12,14H,6-8H2,1-3H3
InChIKeyQQUBCTCKCFFFHP-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.97
Rot. Bonds2

About 2-(3-methoxy-2,4-dimethylphenyl)morpholine

2-(3-methoxy-2,4-dimethylphenyl)morpholine (PubChem CID 117316054) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-(3-methoxy-2,4-dimethylphenyl)morpholine.

Molecular Properties

Compound Name2-(3-methoxy-2,4-dimethylphenyl)morpholine
PubChem CID117316054
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-(3-methoxy-2,4-dimethylphenyl)morpholine
SMILESCOc1c(C)ccc(C2CNCCO2)c1C
InChIInChI=1S/C13H19NO2/c1-9-4-5-11(10(2)13(9)15-3)12-8-14-6-7-16-12/h4-5,12,14H,6-8H2,1-3H3
InChIKeyQQUBCTCKCFFFHP-UHFFFAOYSA-N
XLogP1.97
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-3-morpholin-2-ylphenol
CID 117296490
2-methoxy-3,6-dimethyl-4-morpholin-2-ylphenol
CID 117346877
2-(5-chloro-3,4-dimethoxy-2-methylphenyl)morpholine
CID 117432130
2-(3-chloro-2-methoxy-4,5-dimethylphenyl)morpholine
CID 115004570
2,3-dimethoxy-4-morpholin-2-ylbenzaldehyde
CID 117380901
2-methoxy-5,6-dimethyl-3-morpholin-2-ylphenol
CID 117346862
2-(2-methoxy-3-methyl-6-methylsulfanylphenyl)morpholine
CID 117386739
2-(3-fluoro-2-methoxy-4-methylsulfonylphenyl)morpholine
CID 117467306
2-(3-bromo-2,4-dimethoxyphenyl)morpholine
CID 117486500
3-(3-methoxy-2,4-dimethylphenyl)pyrrolidine
CID 117293921
2-(2-methoxy-4-methylphenyl)morpholine
CID 82611084
2-(2,4-dimethoxy-5-methylphenyl)morpholine
CID 117346886

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-2,4-dimethylphenyl)morpholine?
The IUPAC name of 2-(3-methoxy-2,4-dimethylphenyl)morpholine (CID 117316054) is 2-(3-methoxy-2,4-dimethylphenyl)morpholine.
What is the SMILES notation for 2-(3-methoxy-2,4-dimethylphenyl)morpholine?
The canonical SMILES for 2-(3-methoxy-2,4-dimethylphenyl)morpholine is COc1c(C)ccc(C2CNCCO2)c1C.
What is the InChIKey of 2-(3-methoxy-2,4-dimethylphenyl)morpholine?
The InChIKey is QQUBCTCKCFFFHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-9-4-5-11(10(2)13(9)15-3)12-8-14-6-7-16-12/h4-5,12,14H,6-8H2,1-3H3.
What are the key properties of 2-(3-methoxy-2,4-dimethylphenyl)morpholine?
2-(3-methoxy-2,4-dimethylphenyl)morpholine has a molecular weight of 221.30 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-2,4-dimethylphenyl)morpholine is sourced from PubChem (CID 117316054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).