4-(2-fluoro-2-propylheptyl)morpholine

C14H28FNO — CID 144754868

IUPAC4-(2-fluoro-2-propylheptyl)morpholine
SMILESCCCCCC(F)(CCC)CN1CCOCC1
InChIInChI=1S/C14H28FNO/c1-3-5-6-8-14(15,7-4-2)13-16-9-11-17-12-10-16/h3-13H2,1-2H3
InChIKeyBPIMMBYFIQMPAE-UHFFFAOYSA-N
MW245.38 g/mol
LogP3.41
Rot. Bonds8

About 4-(2-fluoro-2-propylheptyl)morpholine

4-(2-fluoro-2-propylheptyl)morpholine (PubChem CID 144754868) has the molecular formula C14H28FNO and a molecular weight of 245.38 g/mol. Its IUPAC name is 4-(2-fluoro-2-propylheptyl)morpholine.

Molecular Properties

Compound Name4-(2-fluoro-2-propylheptyl)morpholine
PubChem CID144754868
Molecular FormulaC14H28FNO
Molecular Weight245.38 g/mol
Exact Mass245.22
IUPAC Name4-(2-fluoro-2-propylheptyl)morpholine
SMILESCCCCCC(F)(CCC)CN1CCOCC1
InChIInChI=1S/C14H28FNO/c1-3-5-6-8-14(15,7-4-2)13-16-9-11-17-12-10-16/h3-13H2,1-2H3
InChIKeyBPIMMBYFIQMPAE-UHFFFAOYSA-N
XLogP3.41
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.38
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-2-propylheptyl)morpholine?
The IUPAC name of 4-(2-fluoro-2-propylheptyl)morpholine (CID 144754868) is 4-(2-fluoro-2-propylheptyl)morpholine.
What is the SMILES notation for 4-(2-fluoro-2-propylheptyl)morpholine?
The canonical SMILES for 4-(2-fluoro-2-propylheptyl)morpholine is CCCCCC(F)(CCC)CN1CCOCC1.
What is the InChIKey of 4-(2-fluoro-2-propylheptyl)morpholine?
The InChIKey is BPIMMBYFIQMPAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28FNO/c1-3-5-6-8-14(15,7-4-2)13-16-9-11-17-12-10-16/h3-13H2,1-2H3.
What are the key properties of 4-(2-fluoro-2-propylheptyl)morpholine?
4-(2-fluoro-2-propylheptyl)morpholine has a molecular weight of 245.38 g/mol, XLogP of 3.41, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-2-propylheptyl)morpholine is sourced from PubChem (CID 144754868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).