[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol

C12H20N2O2 — CID 61256979

IUPAC[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol
SMILESCCN(CC)CCOc1ncccc1CO
InChIInChI=1S/C12H20N2O2/c1-3-14(4-2)8-9-16-12-11(10-15)6-5-7-13-12/h5-7,15H,3-4,8-10H2,1-2H3
InChIKeyUHTNRYBPKPXJSV-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.29
Rot. Bonds7

About [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol

[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol (PubChem CID 61256979) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol
PubChem CID61256979
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol
SMILESCCN(CC)CCOc1ncccc1CO
InChIInChI=1S/C12H20N2O2/c1-3-14(4-2)8-9-16-12-11(10-15)6-5-7-13-12/h5-7,15H,3-4,8-10H2,1-2H3
InChIKeyUHTNRYBPKPXJSV-UHFFFAOYSA-N
XLogP1.29
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol?
The IUPAC name of [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol (CID 61256979) is [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol?
The canonical SMILES for [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol is CCN(CC)CCOc1ncccc1CO.
What is the InChIKey of [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol?
The InChIKey is UHTNRYBPKPXJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-3-14(4-2)8-9-16-12-11(10-15)6-5-7-13-12/h5-7,15H,3-4,8-10H2,1-2H3.
What are the key properties of [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol?
[2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol has a molecular weight of 224.30 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(diethylamino)ethoxy]-3-pyridinyl]methanol is sourced from PubChem (CID 61256979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).