1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol

C14H21NO2 — CID 43505904

IUPAC1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol
SMILESCC1CN(c2ccc(C(C)O)cc2)CC(C)O1
InChIInChI=1S/C14H21NO2/c1-10-8-15(9-11(2)17-10)14-6-4-13(5-7-14)12(3)16/h4-7,10-12,16H,8-9H2,1-3H3
InChIKeyWYMBYIMPNCLGKP-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.35
Rot. Bonds2

About 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol

1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol (PubChem CID 43505904) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol.

Molecular Properties

Compound Name1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol
PubChem CID43505904
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol
SMILESCC1CN(c2ccc(C(C)O)cc2)CC(C)O1
InChIInChI=1S/C14H21NO2/c1-10-8-15(9-11(2)17-10)14-6-4-13(5-7-14)12(3)16/h4-7,10-12,16H,8-9H2,1-3H3
InChIKeyWYMBYIMPNCLGKP-UHFFFAOYSA-N
XLogP2.35
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethyl-4-(4-propan-2-ylphenyl)morpholine
CID 76587760
1-[4-(2-methylmorpholin-4-yl)phenyl]ethanol
CID 43505918
(1R)-1-[4-(3,5-dimethylpiperidin-1-yl)phenyl]ethanol
CID 78939318
(1R)-1-[4-(2,2,6-trimethylmorpholin-4-yl)phenyl]ethanol
CID 78940812
(1R)-1-[4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)phenyl]ethanol
CID 115560514
(2S)-2,6-dimethyl-4-(4-methylphenyl)morpholine
CID 166696094
(1R)-1-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]propan-1-amine
CID 114066341
(1S)-1-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]propan-1-amine
CID 114066342
(1S)-1-[3-chloro-4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol
CID 78939185
2-[(2S,6S)-6-methyl-4-(4-propan-2-ylphenyl)morpholin-2-yl]propan-2-ol
CID 129268164
[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]methanol
CID 93023320
[4-(2,6-dimethylmorpholin-4-yl)phenyl]methanol
CID 43121035

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol?
The IUPAC name of 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol (CID 43505904) is 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol.
What is the SMILES notation for 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol?
The canonical SMILES for 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol is CC1CN(c2ccc(C(C)O)cc2)CC(C)O1.
What is the InChIKey of 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol?
The InChIKey is WYMBYIMPNCLGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-8-15(9-11(2)17-10)14-6-4-13(5-7-14)12(3)16/h4-7,10-12,16H,8-9H2,1-3H3.
What are the key properties of 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol?
1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol has a molecular weight of 235.33 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,6-dimethylmorpholin-4-yl)phenyl]ethanol is sourced from PubChem (CID 43505904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).