2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol

C16H20N2O2 — CID 107712729

IUPAC2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol
SMILESCNC(C)c1ccc(Oc2ccccc2CCO)nc1
InChIInChI=1S/C16H20N2O2/c1-12(17-2)14-7-8-16(18-11-14)20-15-6-4-3-5-13(15)9-10-19/h3-8,11-12,17,19H,9-10H2,1-2H3
InChIKeyPJXGKASMOWHRFW-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.69
Rot. Bonds6

About 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol

2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol (PubChem CID 107712729) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol.

Molecular Properties

Compound Name2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol
PubChem CID107712729
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol
SMILESCNC(C)c1ccc(Oc2ccccc2CCO)nc1
InChIInChI=1S/C16H20N2O2/c1-12(17-2)14-7-8-16(18-11-14)20-15-6-4-3-5-13(15)9-10-19/h3-8,11-12,17,19H,9-10H2,1-2H3
InChIKeyPJXGKASMOWHRFW-UHFFFAOYSA-N
XLogP2.69
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[2-(2-hydroxyethyl)phenoxy]pyridine-3-carbaldehyde
CID 107712774
2-[2-[5-(aminomethyl)pyrazin-2-yl]oxyphenyl]ethanol
CID 107711701
5-[2-(2-hydroxyethyl)phenoxy]pyrazine-2-carbothioamide
CID 107712486
[2-[[5-(methylaminomethyl)-2-pyridinyl]oxy]phenyl]methanol
CID 80633758
2-[2-[2-[(propan-2-ylamino)methyl]phenoxy]phenyl]ethanol
CID 107712955
3-fluoro-4-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]benzonitrile
CID 107665502
2-(2-pyrido[2,3-b]pyrazin-6-yloxyphenyl)ethanol
CID 107713779
2-[2-(6-methylsulfanylpyrimidin-4-yl)oxyphenyl]ethanol
CID 107713792
1-[2-[(5-chloro-2-pyridinyl)oxy]phenyl]-N-methylmethanamine
CID 106485445
(1R)-1-[3-bromo-4-[2-(2-hydroxyethyl)phenoxy]phenyl]ethanol
CID 107712787
2-[2-(1-phenylethoxy)phenyl]ethanol
CID 107713134
N-[1-[6-(2-fluoro-3-methylphenoxy)-3-pyridinyl]ethyl]propan-1-amine
CID 107658828

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol?
The IUPAC name of 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol (CID 107712729) is 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol.
What is the SMILES notation for 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol?
The canonical SMILES for 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol is CNC(C)c1ccc(Oc2ccccc2CCO)nc1.
What is the InChIKey of 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol?
The InChIKey is PJXGKASMOWHRFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12(17-2)14-7-8-16(18-11-14)20-15-6-4-3-5-13(15)9-10-19/h3-8,11-12,17,19H,9-10H2,1-2H3.
What are the key properties of 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol?
2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol has a molecular weight of 272.35 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[5-[1-(methylamino)ethyl]-2-pyridinyl]oxy]phenyl]ethanol is sourced from PubChem (CID 107712729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).