2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol

C15H25NO3 — CID 111122510

IUPAC2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
SMILESCOc1ccc(C(CO)N(C)CCOC(C)C)cc1
InChIInChI=1S/C15H25NO3/c1-12(2)19-10-9-16(3)15(11-17)13-5-7-14(18-4)8-6-13/h5-8,12,15,17H,9-11H2,1-4H3
InChIKeyUVZLPGZKIJUYAK-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.09
Rot. Bonds8

About 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol

2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol (PubChem CID 111122510) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
PubChem CID111122510
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
SMILESCOc1ccc(C(CO)N(C)CCOC(C)C)cc1
InChIInChI=1S/C15H25NO3/c1-12(2)19-10-9-16(3)15(11-17)13-5-7-14(18-4)8-6-13/h5-8,12,15,17H,9-11H2,1-4H3
InChIKeyUVZLPGZKIJUYAK-UHFFFAOYSA-N
XLogP2.09
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methoxyphenyl)-2-N-methyl-2-N-(2-propan-2-yloxyethyl)propane-1,2-diamine
CID 81055276
2-(4-methoxyphenyl)-2-[methyl(2-piperidin-1-ylethyl)amino]ethanol
CID 111434925
2-[2-[[2-hydroxy-1-(4-methoxyphenyl)ethyl]-methylamino]ethoxy]benzonitrile
CID 111122502
2-[[2-hydroxy-1-(4-methoxyphenyl)ethyl]-methylamino]-N-phenylacetamide
CID 111122600
2-[2-(benzenesulfinyl)ethyl-methylamino]-2-(4-methoxyphenyl)ethanol
CID 111122551
2-(4-methoxyphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]ethanol
CID 111122596
(2S)-2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl-methylamino]-2-(4-methoxyphenyl)ethanol
CID 100683475
4-[[[(1S)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-methylamino]methyl]benzonitrile
CID 95625791
1-(4-methoxyphenyl)-3-propan-2-yloxypropan-1-ol
CID 115001584
4-[[2-amino-1-(4-methoxyphenyl)ethyl]-methylamino]butan-2-ol
CID 113499536
4-[[[(1S)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-methylamino]methyl]-N-methylbenzamide
CID 95625779
2-(4-methoxyphenyl)-2-[methyl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]ethanol
CID 111122549

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
The IUPAC name of 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol (CID 111122510) is 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
The canonical SMILES for 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol is COc1ccc(C(CO)N(C)CCOC(C)C)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
The InChIKey is UVZLPGZKIJUYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-12(2)19-10-9-16(3)15(11-17)13-5-7-14(18-4)8-6-13/h5-8,12,15,17H,9-11H2,1-4H3.
What are the key properties of 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol has a molecular weight of 267.37 g/mol, XLogP of 2.09, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol is sourced from PubChem (CID 111122510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).