2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol

C11H17NO2 — CID 117285517

IUPAC2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol
SMILESCOC(C)c1ccc(C(O)CN)cc1
InChIInChI=1S/C11H17NO2/c1-8(14-2)9-3-5-10(6-4-9)11(13)7-12/h3-6,8,11,13H,7,12H2,1-2H3
InChIKeyAFDRRHYDCLTODS-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.39
Rot. Bonds4

About 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol

2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol (PubChem CID 117285517) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol.

Molecular Properties

Compound Name2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol
PubChem CID117285517
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol
SMILESCOC(C)c1ccc(C(O)CN)cc1
InChIInChI=1S/C11H17NO2/c1-8(14-2)9-3-5-10(6-4-9)11(13)7-12/h3-6,8,11,13H,7,12H2,1-2H3
InChIKeyAFDRRHYDCLTODS-UHFFFAOYSA-N
XLogP1.39
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-[4-(1-hydroxyethyl)phenyl]ethanol
CID 117278888
(1R)-2-amino-1-[4-[(1R)-1,2-dimethoxyethyl]phenyl]ethanol
CID 124500392
2-amino-1-(4-methylphenyl)ethanol;ethane
CID 145260878
2-amino-1-[4-(2-methylpropoxy)phenyl]ethanol
CID 102533878
methyl 4-[(1S)-2-amino-1-hydroxyethyl]benzoate
CID 94590796
(1S)-2-amino-1-(4-ethylphenyl)ethanol
CID 42182576
methyl 2-hydroxy-2-[4-(1-methoxyethyl)phenyl]acetate
CID 117321838
2-amino-1-phenylethanol;ethane
CID 91425169
2-amino-1-[4-(1-methoxycyclopropyl)phenyl]ethanol
CID 117115276
2-amino-1-[4-(trifluoromethoxy)phenyl]ethanol
CID 43209057
4-[(1R)-1-methoxyethyl]benzenethiol
CID 124500513
2-amino-1-[4-(1-ethoxyethoxy)phenyl]ethanol
CID 11379114

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol?
The IUPAC name of 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol (CID 117285517) is 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol.
What is the SMILES notation for 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol?
The canonical SMILES for 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol is COC(C)c1ccc(C(O)CN)cc1.
What is the InChIKey of 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol?
The InChIKey is AFDRRHYDCLTODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8(14-2)9-3-5-10(6-4-9)11(13)7-12/h3-6,8,11,13H,7,12H2,1-2H3.
What are the key properties of 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol?
2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol has a molecular weight of 195.26 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[4-(1-methoxyethyl)phenyl]ethanol is sourced from PubChem (CID 117285517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).