5-methoxy-2-[(3S)-morpholin-3-yl]phenol

C11H15NO3 — CID 96773573

IUPAC5-methoxy-2-[(3S)-morpholin-3-yl]phenol
SMILESCOc1ccc([C@H]2COCCN2)c(O)c1
InChIInChI=1S/C11H15NO3/c1-14-8-2-3-9(11(13)6-8)10-7-15-5-4-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1
InChIKeyIIQQKUBJBYSCOX-SNVBAGLBSA-N
MW209.24 g/mol
LogP1.06
Rot. Bonds2

About 5-methoxy-2-[(3S)-morpholin-3-yl]phenol

5-methoxy-2-[(3S)-morpholin-3-yl]phenol (PubChem CID 96773573) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 5-methoxy-2-[(3S)-morpholin-3-yl]phenol.

Molecular Properties

Compound Name5-methoxy-2-[(3S)-morpholin-3-yl]phenol
PubChem CID96773573
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name5-methoxy-2-[(3S)-morpholin-3-yl]phenol
SMILESCOc1ccc([C@H]2COCCN2)c(O)c1
InChIInChI=1S/C11H15NO3/c1-14-8-2-3-9(11(13)6-8)10-7-15-5-4-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1
InChIKeyIIQQKUBJBYSCOX-SNVBAGLBSA-N
XLogP1.06
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

5-methoxy-2-morpholin-3-ylphenol
CID 82612039
4-methoxy-2-[(3S)-morpholin-3-yl]phenol
CID 131539104
(3S)-3-(2-fluoro-4-methoxyphenyl)morpholine
CID 96776488
3-methoxy-4-morpholin-3-ylphenol
CID 130022201
5-fluoro-2-[(3S)-morpholin-3-yl]phenol
CID 55262699
5-chloro-2-morpholin-3-ylphenol
CID 82613253
(3S)-3-(3-methoxyphenyl)morpholine
CID 42183281
5-methoxy-2-[(2R)-pyrrolidin-2-yl]phenol;hydrochloride
CID 171195842
2-chloro-3-methoxy-4-morpholin-3-ylphenol
CID 84802086
2-morpholin-3-ylphenol
CID 55294349
4-methyl-6-morpholin-3-ylbenzene-1,3-diol
CID 84780563
2-[(3R)-morpholin-3-yl]benzene-1,4-diol;hydrochloride
CID 171192528

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[(3S)-morpholin-3-yl]phenol?
The IUPAC name of 5-methoxy-2-[(3S)-morpholin-3-yl]phenol (CID 96773573) is 5-methoxy-2-[(3S)-morpholin-3-yl]phenol.
What is the SMILES notation for 5-methoxy-2-[(3S)-morpholin-3-yl]phenol?
The canonical SMILES for 5-methoxy-2-[(3S)-morpholin-3-yl]phenol is COc1ccc([C@H]2COCCN2)c(O)c1.
What is the InChIKey of 5-methoxy-2-[(3S)-morpholin-3-yl]phenol?
The InChIKey is IIQQKUBJBYSCOX-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15NO3/c1-14-8-2-3-9(11(13)6-8)10-7-15-5-4-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1.
What are the key properties of 5-methoxy-2-[(3S)-morpholin-3-yl]phenol?
5-methoxy-2-[(3S)-morpholin-3-yl]phenol has a molecular weight of 209.24 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[(3S)-morpholin-3-yl]phenol is sourced from PubChem (CID 96773573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).