2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol

C12H20N2O2 — CID 137425890

IUPAC2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol
SMILESCC(Cc1ccccn1)NCCOCCO
InChIInChI=1S/C12H20N2O2/c1-11(13-6-8-16-9-7-15)10-12-4-2-3-5-14-12/h2-5,11,13,15H,6-10H2,1H3
InChIKeyFIXLCAPZBFSPGM-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.61
Rot. Bonds8

About 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol

2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol (PubChem CID 137425890) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol
PubChem CID137425890
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol
SMILESCC(Cc1ccccn1)NCCOCCO
InChIInChI=1S/C12H20N2O2/c1-11(13-6-8-16-9-7-15)10-12-4-2-3-5-14-12/h2-5,11,13,15H,6-10H2,1H3
InChIKeyFIXLCAPZBFSPGM-UHFFFAOYSA-N
XLogP0.61
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.61
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

N-(2-propan-2-ylsulfanylethyl)-1-pyridin-2-ylpropan-2-amine
CID 137425887
(2R)-N-benzyl-1-pyridin-2-ylpropan-2-amine
CID 125422187
2-[2-[1-(4-aminophenyl)propan-2-ylamino]ethoxy]ethanol
CID 82257190
2-[2-[1-(4-phenylphenyl)ethylamino]ethoxy]ethanol
CID 43207514
2-[3-(2-pyridin-2-ylethylamino)propoxy]ethanol
CID 106310050
2-[2-[1-(4-methoxyphenyl)propan-2-ylamino]ethoxy]ethanol
CID 43508806
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-propan-2-yloxypyridine
CID 118647854
2-[2-[[(1S)-1-thiophen-2-ylethyl]amino]ethoxy]ethanol
CID 28727459
N-propan-2-yl-5-(2-pyridin-2-ylethoxy)pentan-1-amine
CID 62455568
1-(4-bromophenyl)-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 103522112
N-[[6-(2-aminoethyl)-2-pyridinyl]methyl]-1-pyridin-2-ylpropan-2-amine
CID 130305399
(2S)-2-[3-[2-(2-hydroxyethoxy)ethylamino]butanoylamino]-3-phenylpropanoic acid
CID 56645626

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol (CID 137425890) is 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol is CC(Cc1ccccn1)NCCOCCO.
What is the InChIKey of 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol?
The InChIKey is FIXLCAPZBFSPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-11(13-6-8-16-9-7-15)10-12-4-2-3-5-14-12/h2-5,11,13,15H,6-10H2,1H3.
What are the key properties of 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol?
2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol has a molecular weight of 224.30 g/mol, XLogP of 0.61, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-pyridin-2-ylpropan-2-ylamino)ethoxy]ethanol is sourced from PubChem (CID 137425890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).