2-[2-(phenoxymethyl)morpholin-4-yl]ethanol

C13H19NO3 — CID 102567654

IUPAC2-[2-(phenoxymethyl)morpholin-4-yl]ethanol
SMILESOCCN1CCOC(COc2ccccc2)C1
InChIInChI=1S/C13H19NO3/c15-8-6-14-7-9-16-13(10-14)11-17-12-4-2-1-3-5-12/h1-5,13,15H,6-11H2
InChIKeyXKXYFAKMVCAWNU-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.76
Rot. Bonds5

About 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol

2-[2-(phenoxymethyl)morpholin-4-yl]ethanol (PubChem CID 102567654) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol.

Molecular Properties

Compound Name2-[2-(phenoxymethyl)morpholin-4-yl]ethanol
PubChem CID102567654
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-[2-(phenoxymethyl)morpholin-4-yl]ethanol
SMILESOCCN1CCOC(COc2ccccc2)C1
InChIInChI=1S/C13H19NO3/c15-8-6-14-7-9-16-13(10-14)11-17-12-4-2-1-3-5-12/h1-5,13,15H,6-11H2
InChIKeyXKXYFAKMVCAWNU-UHFFFAOYSA-N
XLogP0.76
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(2,6-dichlorophenoxy)methyl]morpholin-4-yl]ethanol
CID 102567713
(2R)-4-[(4-fluorophenyl)methyl]-2-(phenoxymethyl)morpholine
CID 92984963
(2S)-4-[(3,4-dichlorophenyl)methyl]-2-(phenoxymethyl)morpholine
CID 127031497
4-[(4-benzylmorpholin-2-yl)methoxy]benzoic acid
CID 67836991
6-[[2-(phenoxymethyl)morpholin-4-yl]methyl]pyridazin-3-amine
CID 136570310
(2S)-1-[(2R)-2-[(4-methylphenoxy)methyl]morpholin-4-yl]-3-phenoxypropan-2-ol
CID 92985064
(2R)-2-[(4-bromophenoxy)methyl]-4-propylmorpholine
CID 99979881
2-[(2S)-2-(phenoxymethyl)-1-oxa-4-azaspiro[4.5]decan-4-yl]ethanol
CID 11044508
(2R)-2-[(3-bromophenoxy)methyl]-4-propylmorpholine
CID 99979834
2-[(2S)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]ethanol
CID 125000372
3-[(4-ethylmorpholin-2-yl)methoxy]phenol
CID 79171875
4-[(3-methylpyrrolidin-3-yl)methyl]-2-(phenoxymethyl)morpholine;hydrochloride
CID 120903409

Frequently Asked Questions

What is the IUPAC name of 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol?
The IUPAC name of 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol (CID 102567654) is 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol.
What is the SMILES notation for 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol?
The canonical SMILES for 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol is OCCN1CCOC(COc2ccccc2)C1.
What is the InChIKey of 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol?
The InChIKey is XKXYFAKMVCAWNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c15-8-6-14-7-9-16-13(10-14)11-17-12-4-2-1-3-5-12/h1-5,13,15H,6-11H2.
What are the key properties of 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol?
2-[2-(phenoxymethyl)morpholin-4-yl]ethanol has a molecular weight of 237.30 g/mol, XLogP of 0.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(phenoxymethyl)morpholin-4-yl]ethanol is sourced from PubChem (CID 102567654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).