2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol

C14H23NO2 — CID 107709363

IUPAC2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol
SMILESCCNCC(C)COc1ccc(CCO)cc1
InChIInChI=1S/C14H23NO2/c1-3-15-10-12(2)11-17-14-6-4-13(5-7-14)8-9-16/h4-7,12,15-16H,3,8-11H2,1-2H3
InChIKeyPKKUONPRNVCFIW-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.85
Rot. Bonds8

About 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol

2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol (PubChem CID 107709363) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol
PubChem CID107709363
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol
SMILESCCNCC(C)COc1ccc(CCO)cc1
InChIInChI=1S/C14H23NO2/c1-3-15-10-12(2)11-17-14-6-4-13(5-7-14)8-9-16/h4-7,12,15-16H,3,8-11H2,1-2H3
InChIKeyPKKUONPRNVCFIW-UHFFFAOYSA-N
XLogP1.85
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-methyl-3-(4-propylphenoxy)propan-1-amine
CID 62549610
2-methyl-N-propyl-3-(4-propylphenoxy)propan-1-amine
CID 62549611
1-(ethylamino)-3-(4-propylphenoxy)propan-2-ol
CID 62548727
(3S)-4-[4-(2-hydroxyethyl)phenoxy]-3-methylbutanamide
CID 123476714
3-(4-ethoxyphenyl)-N-ethyl-2-methylpropan-1-amine
CID 64666892
3-(3,4-difluorophenoxy)-N-ethyl-2-methylpropan-1-amine
CID 62486090
2-[4-(2,2-dimethoxyethoxy)phenyl]ethanol
CID 69168508
3-(6-bromonaphthalen-2-yl)oxy-N-ethyl-2-methylpropan-1-amine
CID 62459947
3-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
CID 62838562
3-[4-(2-hydroxyethyl)phenoxy]-2-(propan-2-ylamino)propanenitrile
CID 107709808
2-[4-(2-methylbutoxy)phenyl]ethanamine
CID 62105840
2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol
CID 103844538

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol?
The IUPAC name of 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol (CID 107709363) is 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol.
What is the SMILES notation for 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol?
The canonical SMILES for 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol is CCNCC(C)COc1ccc(CCO)cc1.
What is the InChIKey of 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol?
The InChIKey is PKKUONPRNVCFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-3-15-10-12(2)11-17-14-6-4-13(5-7-14)8-9-16/h4-7,12,15-16H,3,8-11H2,1-2H3.
What are the key properties of 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol?
2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol has a molecular weight of 237.34 g/mol, XLogP of 1.85, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(ethylamino)-2-methylpropoxy]phenyl]ethanol is sourced from PubChem (CID 107709363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).