2-[(3S)-4-methylmorpholin-3-yl]ethanol

C7H15NO2 — CID 155290392

IUPAC2-[(3S)-4-methylmorpholin-3-yl]ethanol
SMILESCN1CCOC[C@@H]1CCO
InChIInChI=1S/C7H15NO2/c1-8-3-5-10-6-7(8)2-4-9/h7,9H,2-6H2,1H3/t7-/m0/s1
InChIKeyPONBKCONPCCZAB-ZETCQYMHSA-N
MW145.20 g/mol
LogP-0.30
Rot. Bonds2

About 2-[(3S)-4-methylmorpholin-3-yl]ethanol

2-[(3S)-4-methylmorpholin-3-yl]ethanol (PubChem CID 155290392) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-[(3S)-4-methylmorpholin-3-yl]ethanol.

Molecular Properties

Compound Name2-[(3S)-4-methylmorpholin-3-yl]ethanol
PubChem CID155290392
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-[(3S)-4-methylmorpholin-3-yl]ethanol
SMILESCN1CCOC[C@@H]1CCO
InChIInChI=1S/C7H15NO2/c1-8-3-5-10-6-7(8)2-4-9/h7,9H,2-6H2,1H3/t7-/m0/s1
InChIKeyPONBKCONPCCZAB-ZETCQYMHSA-N
XLogP-0.30
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-4-methylmorpholin-3-yl]ethanol?
The IUPAC name of 2-[(3S)-4-methylmorpholin-3-yl]ethanol (CID 155290392) is 2-[(3S)-4-methylmorpholin-3-yl]ethanol.
What is the SMILES notation for 2-[(3S)-4-methylmorpholin-3-yl]ethanol?
The canonical SMILES for 2-[(3S)-4-methylmorpholin-3-yl]ethanol is CN1CCOC[C@@H]1CCO.
What is the InChIKey of 2-[(3S)-4-methylmorpholin-3-yl]ethanol?
The InChIKey is PONBKCONPCCZAB-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H15NO2/c1-8-3-5-10-6-7(8)2-4-9/h7,9H,2-6H2,1H3/t7-/m0/s1.
What are the key properties of 2-[(3S)-4-methylmorpholin-3-yl]ethanol?
2-[(3S)-4-methylmorpholin-3-yl]ethanol has a molecular weight of 145.20 g/mol, XLogP of -0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-4-methylmorpholin-3-yl]ethanol is sourced from PubChem (CID 155290392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).