2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine

C16H25NO — CID 106292701

IUPAC2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine
SMILESCCCC1(C)CNC(C)C(c2ccc(C)cc2)O1
InChIInChI=1S/C16H25NO/c1-5-10-16(4)11-17-13(3)15(18-16)14-8-6-12(2)7-9-14/h6-9,13,15,17H,5,10-11H2,1-4H3
InChIKeyBQSOZDUALXZOPI-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.60
Rot. Bonds3

About 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine

2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine (PubChem CID 106292701) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine.

Molecular Properties

Compound Name2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine
PubChem CID106292701
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine
SMILESCCCC1(C)CNC(C)C(c2ccc(C)cc2)O1
InChIInChI=1S/C16H25NO/c1-5-10-16(4)11-17-13(3)15(18-16)14-8-6-12(2)7-9-14/h6-9,13,15,17H,5,10-11H2,1-4H3
InChIKeyBQSOZDUALXZOPI-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dimethyl-6-phenyl-2-propylmorpholine
CID 114169395
2,2,5-trimethyl-6-(4-methylphenyl)morpholine
CID 65102432
6-(3-chlorophenyl)-2,5-dimethyl-2-propylmorpholine
CID 114169389
(2R,3S)-3-methyl-2-(4-methylphenyl)morpholine
CID 93262596
5,5-dimethyl-2-(4-methylphenyl)-1,3-oxazolidine
CID 82281406
2-methyl-2-propyl-6-(4-propylphenyl)morpholine
CID 106292577
8-methyl-7-phenyl-6-oxa-9-azaspiro[4.5]decane
CID 65103492
3-ethyl-3-methyl-2-(4-methylphenyl)azetidine
CID 130575152
5-ethyl-3-methyl-2-(4-methylphenyl)morpholine
CID 43366887
2-methyl-6-(5-methylthiophen-2-yl)-2-propylmorpholine
CID 106292479
2,2-dimethyl-4-(4-methylphenyl)oxetane
CID 12731994
2-(4-ethylphenyl)-3-methylmorpholine
CID 43310155

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine?
The IUPAC name of 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine (CID 106292701) is 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine.
What is the SMILES notation for 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine?
The canonical SMILES for 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine is CCCC1(C)CNC(C)C(c2ccc(C)cc2)O1.
What is the InChIKey of 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine?
The InChIKey is BQSOZDUALXZOPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-5-10-16(4)11-17-13(3)15(18-16)14-8-6-12(2)7-9-14/h6-9,13,15,17H,5,10-11H2,1-4H3.
What are the key properties of 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine?
2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine has a molecular weight of 247.38 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-6-(4-methylphenyl)-2-propylmorpholine is sourced from PubChem (CID 106292701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).