2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol

C7H15NO2 — CID 124552327

IUPAC2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol
SMILESC[C@H]1CN[C@H](CCO)CO1
InChIInChI=1S/C7H15NO2/c1-6-4-8-7(2-3-9)5-10-6/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyNCRFKZNXNSOKBZ-NKWVEPMBSA-N
MW145.20 g/mol
LogP-0.25
Rot. Bonds2

About 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol

2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol (PubChem CID 124552327) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol.

Molecular Properties

Compound Name2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol
PubChem CID124552327
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol
SMILESC[C@H]1CN[C@H](CCO)CO1
InChIInChI=1S/C7H15NO2/c1-6-4-8-7(2-3-9)5-10-6/h6-9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyNCRFKZNXNSOKBZ-NKWVEPMBSA-N
XLogP-0.25
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol?
The IUPAC name of 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol (CID 124552327) is 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol.
What is the SMILES notation for 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol?
The canonical SMILES for 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol is C[C@H]1CN[C@H](CCO)CO1.
What is the InChIKey of 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol?
The InChIKey is NCRFKZNXNSOKBZ-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H15NO2/c1-6-4-8-7(2-3-9)5-10-6/h6-9H,2-5H2,1H3/t6-,7+/m0/s1.
What are the key properties of 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol?
2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol has a molecular weight of 145.20 g/mol, XLogP of -0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R,6S)-6-methylmorpholin-3-yl]ethanol is sourced from PubChem (CID 124552327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).