[(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol

C8H17NO2 — CID 124653594

IUPAC[(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol
SMILESCC(C)[C@@H]1COC[C@@H](CO)N1
InChIInChI=1S/C8H17NO2/c1-6(2)8-5-11-4-7(3-10)9-8/h6-10H,3-5H2,1-2H3/t7-,8+/m1/s1
InChIKeyHWOVXSYKAXNDRJ-SFYZADRCSA-N
MW159.23 g/mol
LogP-0.01
Rot. Bonds2

About [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol

[(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol (PubChem CID 124653594) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol.

Molecular Properties

Compound Name[(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol
PubChem CID124653594
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name[(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol
SMILESCC(C)[C@@H]1COC[C@@H](CO)N1
InChIInChI=1S/C8H17NO2/c1-6(2)8-5-11-4-7(3-10)9-8/h6-10H,3-5H2,1-2H3/t7-,8+/m1/s1
InChIKeyHWOVXSYKAXNDRJ-SFYZADRCSA-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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Frequently Asked Questions

What is the IUPAC name of [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol?
The IUPAC name of [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol (CID 124653594) is [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol.
What is the SMILES notation for [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol?
The canonical SMILES for [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol is CC(C)[C@@H]1COC[C@@H](CO)N1.
What is the InChIKey of [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol?
The InChIKey is HWOVXSYKAXNDRJ-SFYZADRCSA-N. The full InChI is InChI=1S/C8H17NO2/c1-6(2)8-5-11-4-7(3-10)9-8/h6-10H,3-5H2,1-2H3/t7-,8+/m1/s1.
What are the key properties of [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol?
[(3R,5R)-5-propan-2-ylmorpholin-3-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 [(3R,5R)-5-propan-2-ylmorpholin-3-yl]methanol is sourced from PubChem (CID 124653594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).