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

C11H22FNO2 — CID 124842414

IUPAC[(2S,6S)-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-/m0/s1
InChIKeyCCHATHHODYUEIF-QWRGUYRKSA-N
MW219.30 g/mol
LogP1.21
Rot. Bonds6

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

[(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol (PubChem CID 124842414) has the molecular formula C11H22FNO2 and a molecular weight of 219.30 g/mol. Its IUPAC name is [(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol
PubChem CID124842414
Molecular FormulaC11H22FNO2
Molecular Weight219.30 g/mol
Exact Mass219.16
IUPAC Name[(2S,6S)-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-/m0/s1
InChIKeyCCHATHHODYUEIF-QWRGUYRKSA-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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Related Compounds

3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanamide
CID 102935428
2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol
CID 102934999
[4-(2-azidoethyl)-6-methylmorpholin-2-yl]methanol
CID 102935371
(6-methyl-4-octylmorpholin-2-yl)methanamine
CID 102938785
N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide
CID 102935847
(6-methyl-4-pent-3-ynylmorpholin-2-yl)methanol
CID 102935514
3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide
CID 102938189
potassium trifluoro-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]boranuide
CID 102938204
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-methylpropan-2-ol
CID 102934996
1-(2,6-dimethylmorpholin-4-yl)-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 102935864
[4-[[1-(2-aminoethyl)cyclopropyl]methyl]-6-methylmorpholin-2-yl]methanol
CID 102932273
2,6-dimethyl-4-tritriacontylmorpholine
CID 150123657

Frequently Asked Questions

What is the IUPAC name of [(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol (CID 124842414) is [(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [(2S,6S)-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,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
The InChIKey is CCHATHHODYUEIF-QWRGUYRKSA-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-/m0/s1.
What are the key properties of [(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol?
[(2S,6S)-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,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 124842414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).