2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol

C14H23NO2 — CID 130537128

IUPAC2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)CCOCc1ccccc1
InChIInChI=1S/C14H23NO2/c1-13(2)15(8-10-16)9-11-17-12-14-6-4-3-5-7-14/h3-7,13,16H,8-12H2,1-2H3
InChIKeyZTNJXWPFZVHTEP-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.91
Rot. Bonds8

About 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol

2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol (PubChem CID 130537128) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol
PubChem CID130537128
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)CCOCc1ccccc1
InChIInChI=1S/C14H23NO2/c1-13(2)15(8-10-16)9-11-17-12-14-6-4-3-5-7-14/h3-7,13,16H,8-12H2,1-2H3
InChIKeyZTNJXWPFZVHTEP-UHFFFAOYSA-N
XLogP1.91
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-bromoethyl)-N-(2-phenylmethoxyethyl)propan-2-amine
CID 130537232
4-methyl-7-phenylmethoxyheptan-1-ol
CID 142091030
2-[2-(2-chlorophenoxy)ethyl-propan-2-ylamino]ethanol
CID 60691858
2-[methyl(2-phenylmethoxyethyl)amino]propanamide
CID 130767373
1-[2-hydroxyethyl(propan-2-yl)amino]-3-phenylpropan-2-one
CID 62030901
N-[2-(2-aminoethoxy)ethyl]-N-benzylpropan-2-amine
CID 79479672
1-(2-phenylmethoxyethoxy)ethanol
CID 121292346
2-[(2S)-1-phenylmethoxypropan-2-yl]oxyethanol
CID 165127908
2-[3-(2-aminophenoxy)propyl-propan-2-ylamino]ethanol
CID 54996120
N,N-dimethyl-4-phenylmethoxybutan-2-amine
CID 142063705
N,2-dimethyl-N-(2-phenylmethoxyethyl)propan-2-amine
CID 23381577
2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol
CID 103182683

Frequently Asked Questions

What is the IUPAC name of 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol?
The IUPAC name of 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol (CID 130537128) is 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol.
What is the SMILES notation for 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol?
The canonical SMILES for 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol is CC(C)N(CCO)CCOCc1ccccc1.
What is the InChIKey of 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol?
The InChIKey is ZTNJXWPFZVHTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-13(2)15(8-10-16)9-11-17-12-14-6-4-3-5-7-14/h3-7,13,16H,8-12H2,1-2H3.
What are the key properties of 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol?
2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol has a molecular weight of 237.34 g/mol, XLogP of 1.91, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol is sourced from PubChem (CID 130537128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).