2-(fluoromethyl)-6-methyl-4-propylmorpholine

C9H18FNO — CID 177186718

IUPAC2-(fluoromethyl)-6-methyl-4-propylmorpholine
SMILESCCCN1CC(C)OC(CF)C1
InChIInChI=1S/C9H18FNO/c1-3-4-11-6-8(2)12-9(5-10)7-11/h8-9H,3-7H2,1-2H3
InChIKeyFOARQJQIDWEVEA-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.46
Rot. Bonds3

About 2-(fluoromethyl)-6-methyl-4-propylmorpholine

2-(fluoromethyl)-6-methyl-4-propylmorpholine (PubChem CID 177186718) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 2-(fluoromethyl)-6-methyl-4-propylmorpholine.

Molecular Properties

Compound Name2-(fluoromethyl)-6-methyl-4-propylmorpholine
PubChem CID177186718
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name2-(fluoromethyl)-6-methyl-4-propylmorpholine
SMILESCCCN1CC(C)OC(CF)C1
InChIInChI=1S/C9H18FNO/c1-3-4-11-6-8(2)12-9(5-10)7-11/h8-9H,3-7H2,1-2H3
InChIKeyFOARQJQIDWEVEA-UHFFFAOYSA-N
XLogP1.46
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-6-methyl-4-propylmorpholine?
The IUPAC name of 2-(fluoromethyl)-6-methyl-4-propylmorpholine (CID 177186718) is 2-(fluoromethyl)-6-methyl-4-propylmorpholine.
What is the SMILES notation for 2-(fluoromethyl)-6-methyl-4-propylmorpholine?
The canonical SMILES for 2-(fluoromethyl)-6-methyl-4-propylmorpholine is CCCN1CC(C)OC(CF)C1.
What is the InChIKey of 2-(fluoromethyl)-6-methyl-4-propylmorpholine?
The InChIKey is FOARQJQIDWEVEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c1-3-4-11-6-8(2)12-9(5-10)7-11/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-(fluoromethyl)-6-methyl-4-propylmorpholine?
2-(fluoromethyl)-6-methyl-4-propylmorpholine has a molecular weight of 175.25 g/mol, XLogP of 1.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-6-methyl-4-propylmorpholine is sourced from PubChem (CID 177186718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).