2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one

C19H20F3NO3 — CID 56870679

IUPAC2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one
SMILESCC(C)(Oc1cccc2ccccc12)C(=O)N1CCOC(C(F)(F)F)C1
InChIInChI=1S/C19H20F3NO3/c1-18(2,17(24)23-10-11-25-16(12-23)19(20,21)22)26-15-9-5-7-13-6-3-4-8-14(13)15/h3-9,16H,10-12H2,1-2H3
InChIKeyAQARJQMHRYAMOY-UHFFFAOYSA-N
MW367.37 g/mol
LogP3.79
Rot. Bonds3

About 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one

2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one (PubChem CID 56870679) has the molecular formula C19H20F3NO3 and a molecular weight of 367.37 g/mol. Its IUPAC name is 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one
PubChem CID56870679
Molecular FormulaC19H20F3NO3
Molecular Weight367.37 g/mol
Exact Mass367.14
IUPAC Name2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one
SMILESCC(C)(Oc1cccc2ccccc12)C(=O)N1CCOC(C(F)(F)F)C1
InChIInChI=1S/C19H20F3NO3/c1-18(2,17(24)23-10-11-25-16(12-23)19(20,21)22)26-15-9-5-7-13-6-3-4-8-14(13)15/h3-9,16H,10-12H2,1-2H3
InChIKeyAQARJQMHRYAMOY-UHFFFAOYSA-N
XLogP3.79
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.37
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one?
The IUPAC name of 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one (CID 56870679) is 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one.
What is the SMILES notation for 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one?
The canonical SMILES for 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one is CC(C)(Oc1cccc2ccccc12)C(=O)N1CCOC(C(F)(F)F)C1.
What is the InChIKey of 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one?
The InChIKey is AQARJQMHRYAMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3NO3/c1-18(2,17(24)23-10-11-25-16(12-23)19(20,21)22)26-15-9-5-7-13-6-3-4-8-14(13)15/h3-9,16H,10-12H2,1-2H3.
What are the key properties of 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one?
2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one has a molecular weight of 367.37 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-naphthalen-1-yloxy-1-[2-(trifluoromethyl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 56870679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).