[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol

C8H17NO2 — CID 169228692

IUPAC[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol
SMILESCC(C)[C@@H]1CNC[C@@H](CO)O1
InChIInChI=1S/C8H17NO2/c1-6(2)8-4-9-3-7(5-10)11-8/h6-10H,3-5H2,1-2H3/t7-,8-/m0/s1
InChIKeyLQODQOJZODNBPF-YUMQZZPRSA-N
MW159.23 g/mol
LogP-0.01
Rot. Bonds2

About [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol

[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol (PubChem CID 169228692) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol
PubChem CID169228692
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol
SMILESCC(C)[C@@H]1CNC[C@@H](CO)O1
InChIInChI=1S/C8H17NO2/c1-6(2)8-4-9-3-7(5-10)11-8/h6-10H,3-5H2,1-2H3/t7-,8-/m0/s1
InChIKeyLQODQOJZODNBPF-YUMQZZPRSA-N
XLogP-0.01
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;(5-propan-2-yloxolan-2-yl)methanol
CID 170570841
[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol
CID 169228697
[(6R)-6-(trifluoromethyl)morpholin-2-yl]methanol
CID 139358124
[(2R,6R)-6-methylmorpholin-2-yl]methanol;2,2,2-trifluoroacetic acid
CID 146272591
2-benzhydryl-6-ethylmorpholine
CID 107292987
[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol
CID 169228660
[(3aR,6aR)-3,3a,4,5,6,6a-hexahydro-2H-furo[2,3-c]pyrrol-2-yl]methanol
CID 127264235
(2R,6R)-2-[5-[(3R,5R)-5-methylthiomorpholin-3-yl]hexan-2-yl]-6-propan-2-ylmorpholine
CID 139310342
tert-butyl (2S,6R)-2-(hydroxymethyl)-6-propan-2-ylmorpholine-4-carboxylate
CID 169228635
[(2S,3aS,6aS)-3,3a,4,5,6,6a-hexahydro-2H-furo[2,3-c]pyrrol-2-yl]methanol;hydrochloride
CID 127264226
[(2R)-morpholin-2-yl]methanol;hydrochloride
CID 42614735
1-[(6S)-6-(hydroxymethyl)morpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 167109570

Frequently Asked Questions

What is the IUPAC name of [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol?
The IUPAC name of [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol (CID 169228692) is [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol.
What is the SMILES notation for [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol?
The canonical SMILES for [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol is CC(C)[C@@H]1CNC[C@@H](CO)O1.
What is the InChIKey of [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol?
The InChIKey is LQODQOJZODNBPF-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H17NO2/c1-6(2)8-4-9-3-7(5-10)11-8/h6-10H,3-5H2,1-2H3/t7-,8-/m0/s1.
What are the key properties of [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol?
[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol has a molecular weight of 159.23 g/mol, XLogP of -0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol is sourced from PubChem (CID 169228692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).