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

C11H15NO3 — CID 131539104

IUPAC4-methoxy-2-[(3S)-morpholin-3-yl]phenol
SMILESCOc1ccc(O)c([C@H]2COCCN2)c1
InChIInChI=1S/C11H15NO3/c1-14-8-2-3-11(13)9(6-8)10-7-15-5-4-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1
InChIKeyRNWCGGMLTNUMOQ-SNVBAGLBSA-N
MW209.24 g/mol
LogP1.06
Rot. Bonds2

About 4-methoxy-2-[(3S)-morpholin-3-yl]phenol

4-methoxy-2-[(3S)-morpholin-3-yl]phenol (PubChem CID 131539104) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 4-methoxy-2-[(3S)-morpholin-3-yl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[(3S)-morpholin-3-yl]phenol
PubChem CID131539104
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name4-methoxy-2-[(3S)-morpholin-3-yl]phenol
SMILESCOc1ccc(O)c([C@H]2COCCN2)c1
InChIInChI=1S/C11H15NO3/c1-14-8-2-3-11(13)9(6-8)10-7-15-5-4-12-10/h2-3,6,10,12-13H,4-5,7H2,1H3/t10-/m1/s1
InChIKeyRNWCGGMLTNUMOQ-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
5-methoxy-2-[(3S)-morpholin-3-yl]phenol
CID 96773573
(3S)-3-(2-fluoro-4-methoxyphenyl)morpholine
CID 96776488
2-[(3R)-morpholin-3-yl]benzene-1,4-diol;hydrochloride
CID 171192528
4-amino-2-[(3R)-morpholin-3-yl]phenol
CID 131097023
2-[(2S)-azetidin-2-yl]-4-methoxyphenol;hydrochloride
CID 171196735
4-methoxy-2-[(2R)-piperidin-2-yl]phenol
CID 131513044
4-methoxy-2-[(2S)-piperidin-2-yl]phenol
CID 131531573
2-chloro-3-methoxy-4-morpholin-3-ylphenol
CID 84802086
2-morpholin-3-ylphenol
CID 55294349
3-methoxy-4-morpholin-3-ylphenol
CID 130022201
2-[(3S)-morpholin-3-yl]-4-(trifluoromethyl)phenol
CID 171259740

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(3S)-morpholin-3-yl]phenol?
The IUPAC name of 4-methoxy-2-[(3S)-morpholin-3-yl]phenol (CID 131539104) is 4-methoxy-2-[(3S)-morpholin-3-yl]phenol.
What is the SMILES notation for 4-methoxy-2-[(3S)-morpholin-3-yl]phenol?
The canonical SMILES for 4-methoxy-2-[(3S)-morpholin-3-yl]phenol is COc1ccc(O)c([C@H]2COCCN2)c1.
What is the InChIKey of 4-methoxy-2-[(3S)-morpholin-3-yl]phenol?
The InChIKey is RNWCGGMLTNUMOQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15NO3/c1-14-8-2-3-11(13)9(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 4-methoxy-2-[(3S)-morpholin-3-yl]phenol?
4-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 4-methoxy-2-[(3S)-morpholin-3-yl]phenol is sourced from PubChem (CID 131539104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).