[(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol

C11H22FNO2 — CID 124842413

IUPAC[(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol
SMILESC[C@@H]1CN(CCCCCF)C[C@@H](CO)O1
InChIInChI=1S/C11H22FNO2/c1-10-7-13(6-4-2-3-5-12)8-11(9-14)15-10/h10-11,14H,2-9H2,1H3/t10-,11+/m1/s1
InChIKeyCCHATHHODYUEIF-MNOVXSKESA-N
MW219.30 g/mol
LogP1.21
Rot. Bonds6

About [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol

[(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol (PubChem CID 124842413) has the molecular formula C11H22FNO2 and a molecular weight of 219.30 g/mol. Its IUPAC name is [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol
PubChem CID124842413
Molecular FormulaC11H22FNO2
Molecular Weight219.30 g/mol
Exact Mass219.16
IUPAC Name[(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol
SMILESC[C@@H]1CN(CCCCCF)C[C@@H](CO)O1
InChIInChI=1S/C11H22FNO2/c1-10-7-13(6-4-2-3-5-12)8-11(9-14)15-10/h10-11,14H,2-9H2,1H3/t10-,11+/m1/s1
InChIKeyCCHATHHODYUEIF-MNOVXSKESA-N
XLogP1.21
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.30
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol (CID 124842413) is [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol is C[C@@H]1CN(CCCCCF)C[C@@H](CO)O1.
What is the InChIKey of [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
The InChIKey is CCHATHHODYUEIF-MNOVXSKESA-N. The full InChI is InChI=1S/C11H22FNO2/c1-10-7-13(6-4-2-3-5-12)8-11(9-14)15-10/h10-11,14H,2-9H2,1H3/t10-,11+/m1/s1.
What are the key properties of [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
[(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol has a molecular weight of 219.30 g/mol, XLogP of 1.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6R)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 124842413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).