2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol

C11H16N2O3 — CID 71182932

IUPAC2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol
SMILESNC(CO)c1ccc(OC2CCOC2)nc1
InChIInChI=1S/C11H16N2O3/c12-10(6-14)8-1-2-11(13-5-8)16-9-3-4-15-7-9/h1-2,5,9-10,14H,3-4,6-7,12H2
InChIKeyNBJWZGHNHFNOJH-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.24
Rot. Bonds4

About 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol

2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol (PubChem CID 71182932) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol
PubChem CID71182932
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol
SMILESNC(CO)c1ccc(OC2CCOC2)nc1
InChIInChI=1S/C11H16N2O3/c12-10(6-14)8-1-2-11(13-5-8)16-9-3-4-15-7-9/h1-2,5,9-10,14H,3-4,6-7,12H2
InChIKeyNBJWZGHNHFNOJH-UHFFFAOYSA-N
XLogP0.24
TPSA77.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol?
The IUPAC name of 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol (CID 71182932) is 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol.
What is the SMILES notation for 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol?
The canonical SMILES for 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol is NC(CO)c1ccc(OC2CCOC2)nc1.
What is the InChIKey of 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol?
The InChIKey is NBJWZGHNHFNOJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c12-10(6-14)8-1-2-11(13-5-8)16-9-3-4-15-7-9/h1-2,5,9-10,14H,3-4,6-7,12H2.
What are the key properties of 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol?
2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol has a molecular weight of 224.26 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[6-(oxolan-3-yloxy)-3-pyridinyl]ethanol is sourced from PubChem (CID 71182932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).