2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine

C12H15F3N2O — CID 118899233

IUPAC2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine
SMILESCc1nc(N2CCOC(C)C2)ccc1C(F)(F)F
InChIInChI=1S/C12H15F3N2O/c1-8-7-17(5-6-18-8)11-4-3-10(9(2)16-11)12(13,14)15/h3-4,8H,5-7H2,1-2H3
InChIKeyZTRLDHCGQDHASS-UHFFFAOYSA-N
MW260.26 g/mol
LogP2.63
Rot. Bonds1

About 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine

2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine (PubChem CID 118899233) has the molecular formula C12H15F3N2O and a molecular weight of 260.26 g/mol. Its IUPAC name is 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine
PubChem CID118899233
Molecular FormulaC12H15F3N2O
Molecular Weight260.26 g/mol
Exact Mass260.11
IUPAC Name2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine
SMILESCc1nc(N2CCOC(C)C2)ccc1C(F)(F)F
InChIInChI=1S/C12H15F3N2O/c1-8-7-17(5-6-18-8)11-4-3-10(9(2)16-11)12(13,14)15/h3-4,8H,5-7H2,1-2H3
InChIKeyZTRLDHCGQDHASS-UHFFFAOYSA-N
XLogP2.63
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine?
The IUPAC name of 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine (CID 118899233) is 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine.
What is the SMILES notation for 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine?
The canonical SMILES for 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine is Cc1nc(N2CCOC(C)C2)ccc1C(F)(F)F.
What is the InChIKey of 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine?
The InChIKey is ZTRLDHCGQDHASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O/c1-8-7-17(5-6-18-8)11-4-3-10(9(2)16-11)12(13,14)15/h3-4,8H,5-7H2,1-2H3.
What are the key properties of 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine?
2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine has a molecular weight of 260.26 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[6-methyl-5-(trifluoromethyl)-2-pyridinyl]morpholine is sourced from PubChem (CID 118899233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).