molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol

C15H20N2O2 — CID 171653208

IUPACmolecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol
SMILESOCCNCCc1cccc(Oc2ccccn2)c1.[H][H]
InChIInChI=1S/C15H18N2O2.H2/c18-11-10-16-9-7-13-4-3-5-14(12-13)19-15-6-1-2-8-17-15;/h1-6,8,12,16,18H,7,9-11H2;1H
InChIKeyFBTAETPIPPUQGK-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.24
Rot. Bonds7

About molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol

molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol (PubChem CID 171653208) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol.

Molecular Properties

Compound Namemolecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol
PubChem CID171653208
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Namemolecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol
SMILESOCCNCCc1cccc(Oc2ccccn2)c1.[H][H]
InChIInChI=1S/C15H18N2O2.H2/c18-11-10-16-9-7-13-4-3-5-14(12-13)19-15-6-1-2-8-17-15;/h1-6,8,12,16,18H,7,9-11H2;1H
InChIKeyFBTAETPIPPUQGK-UHFFFAOYSA-N
XLogP2.24
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(methoxymethyl)phenoxy]pyridine
CID 174239052
2-methyl-N-[(3-pyridin-2-yloxyphenyl)methyl]propan-2-amine
CID 71120054
2-(3-methoxyphenyl)-N-(2-pyridin-2-ylethyl)ethanamine
CID 107852157
2-methoxy-N-[(3-pyridin-2-yloxyphenyl)methyl]acetamide
CID 90596122
2-[2-(3-methyl-5-pyridazin-3-yloxyphenyl)ethylamino]ethanol
CID 171653167
2-[2-(3-fluoro-5-pyridazin-3-yloxyphenyl)ethylamino]ethanol
CID 171653205
(E)-N-[(3-pyridin-2-yloxyphenyl)methyl]but-2-enamide
CID 90596212
4-[3-(3-pyridin-2-yloxyphenyl)propyl]morpholine
CID 170869968
N-[(3-phenoxyphenyl)methyl]-2-pyridin-2-ylethanamine
CID 21071539
N-[(3-pyridin-2-yloxyphenyl)methyl]-1,2-oxazole-5-carboxamide
CID 90596022
5-bromo-N-[(3-pyridin-2-yloxyphenyl)methyl]furan-2-carboxamide
CID 90596276
N-(3-pyridin-2-yloxyphenyl)formamide
CID 91518983

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol?
The IUPAC name of molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol (CID 171653208) is molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol.
What is the SMILES notation for molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol?
The canonical SMILES for molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol is OCCNCCc1cccc(Oc2ccccn2)c1.[H][H].
What is the InChIKey of molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol?
The InChIKey is FBTAETPIPPUQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2.H2/c18-11-10-16-9-7-13-4-3-5-14(12-13)19-15-6-1-2-8-17-15;/h1-6,8,12,16,18H,7,9-11H2;1H.
What are the key properties of molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol?
molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;2-[2-(3-pyridin-2-yloxyphenyl)ethylamino]ethanol is sourced from PubChem (CID 171653208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).