2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol

C13H20N2O3 — CID 117384184

IUPAC2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol
SMILESCOc1ccc(N2CCOCC2)cc1C(O)CN
InChIInChI=1S/C13H20N2O3/c1-17-13-3-2-10(8-11(13)12(16)9-14)15-4-6-18-7-5-15/h2-3,8,12,16H,4-7,9,14H2,1H3
InChIKeyPUFBQOYSDXABIR-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.52
Rot. Bonds4

About 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol

2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol (PubChem CID 117384184) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol.

Molecular Properties

Compound Name2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol
PubChem CID117384184
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol
SMILESCOc1ccc(N2CCOCC2)cc1C(O)CN
InChIInChI=1S/C13H20N2O3/c1-17-13-3-2-10(8-11(13)12(16)9-14)15-4-6-18-7-5-15/h2-3,8,12,16H,4-7,9,14H2,1H3
InChIKeyPUFBQOYSDXABIR-UHFFFAOYSA-N
XLogP0.52
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

3-(2-methoxy-5-morpholin-4-ylphenyl)butan-1-amine
CID 117415712
2-amino-1-[2-methoxy-5-(oxan-4-yl)phenyl]ethanol
CID 117381624
(E)-3-(2-methoxy-5-morpholin-4-ylphenyl)prop-2-en-1-amine
CID 117374281
2-ethyl-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide
CID 110359745
methyl 2-hydroxy-2-(2-hydroxy-5-morpholin-4-ylphenyl)acetate
CID 117421323
2-amino-1-(2-morpholin-4-ylphenyl)ethanol
CID 82617214
4-(3,4-diethoxyphenyl)morpholine
CID 154477521
3-(2-methoxy-5-morpholin-4-ylphenyl)propanoic acid
CID 117417021
2-amino-1-(4-methyl-2-morpholin-4-ylphenyl)ethanol
CID 117115348
4-[3,5-dimethoxy-4-[(2-methoxy-4-morpholin-4-ylphenyl)methyl]phenyl]morpholine
CID 135200868
1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine
CID 117469481
2-amino-1-[5-(dimethylamino)-2-methoxyphenyl]ethanol
CID 117300657

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol?
The IUPAC name of 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol (CID 117384184) is 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol.
What is the SMILES notation for 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol?
The canonical SMILES for 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol is COc1ccc(N2CCOCC2)cc1C(O)CN.
What is the InChIKey of 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol?
The InChIKey is PUFBQOYSDXABIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-17-13-3-2-10(8-11(13)12(16)9-14)15-4-6-18-7-5-15/h2-3,8,12,16H,4-7,9,14H2,1H3.
What are the key properties of 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol?
2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol has a molecular weight of 252.31 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol is sourced from PubChem (CID 117384184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).