(3S)-3-methylmorpholine

C5H11NO — CID 12012220

IUPAC(3S)-3-methylmorpholine
SMILESC[C@H]1COCCN1
InChIInChI=1S/C5H11NO/c1-5-4-7-3-2-6-5/h5-6H,2-4H2,1H3/t5-/m0/s1
InChIKeySFWWGMKXCYLZEG-YFKPBYRVSA-N
MW101.15 g/mol
LogP-0.01
Rot. Bonds

About (3S)-3-methylmorpholine

(3S)-3-methylmorpholine (PubChem CID 12012220) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (3S)-3-methylmorpholine.

Molecular Properties

Compound Name(3S)-3-methylmorpholine
PubChem CID12012220
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(3S)-3-methylmorpholine
SMILESC[C@H]1COCCN1
InChIInChI=1S/C5H11NO/c1-5-4-7-3-2-6-5/h5-6H,2-4H2,1H3/t5-/m0/s1
InChIKeySFWWGMKXCYLZEG-YFKPBYRVSA-N
XLogP-0.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-methylmorpholine?
The IUPAC name of (3S)-3-methylmorpholine (CID 12012220) is (3S)-3-methylmorpholine.
What is the SMILES notation for (3S)-3-methylmorpholine?
The canonical SMILES for (3S)-3-methylmorpholine is C[C@H]1COCCN1.
What is the InChIKey of (3S)-3-methylmorpholine?
The InChIKey is SFWWGMKXCYLZEG-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H11NO/c1-5-4-7-3-2-6-5/h5-6H,2-4H2,1H3/t5-/m0/s1.
What are the key properties of (3S)-3-methylmorpholine?
(3S)-3-methylmorpholine has a molecular weight of 101.15 g/mol, XLogP of -0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methylmorpholine is sourced from PubChem (CID 12012220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).