1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol

C13H15NO2 — CID 83175179

IUPAC1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol
SMILESCCc1cnccc1C(O)Cc1ccco1
InChIInChI=1S/C13H15NO2/c1-2-10-9-14-6-5-12(10)13(15)8-11-4-3-7-16-11/h3-7,9,13,15H,2,8H2,1H3
InChIKeyYRMPQOBGOOWQTE-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.51
Rot. Bonds4

About 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol

1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol (PubChem CID 83175179) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol.

Molecular Properties

Compound Name1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol
PubChem CID83175179
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol
SMILESCCc1cnccc1C(O)Cc1ccco1
InChIInChI=1S/C13H15NO2/c1-2-10-9-14-6-5-12(10)13(15)8-11-4-3-7-16-11/h3-7,9,13,15H,2,8H2,1H3
InChIKeyYRMPQOBGOOWQTE-UHFFFAOYSA-N
XLogP2.51
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(furan-2-yl)-1-(4-methyl-3-pyridinyl)ethanol
CID 83171669
N-[2-(furan-2-yl)-1-(3-methyl-4-pyridinyl)ethyl]propan-1-amine
CID 83182976
1-(3-fluoro-4-pyridinyl)-3-(furan-2-yl)propan-1-ol
CID 105126839
2-(furan-2-yl)-N-methyl-1-(3-methyl-4-pyridinyl)ethanamine
CID 83182779
2-(furan-2-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105122925
2-(furan-2-yl)-1-(2-methylthiophen-3-yl)ethanol
CID 130581429
1-(2,5-dimethylphenyl)-2-(furan-2-yl)ethanol
CID 83172156
1-(2-fluoro-3-methylphenyl)-2-(furan-2-yl)ethanol
CID 115830188
2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanol
CID 83175177
1-(4-ethylthiadiazol-5-yl)-2-(furan-2-yl)ethanol
CID 105122955
(7-chloro-1-benzofuran-2-yl)-(3-ethyl-4-pyridinyl)methanol
CID 114727190
2-(furan-2-yl)-1-(6-methyl-3-pyridinyl)ethanol
CID 104823068

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol?
The IUPAC name of 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol (CID 83175179) is 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol.
What is the SMILES notation for 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol?
The canonical SMILES for 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol is CCc1cnccc1C(O)Cc1ccco1.
What is the InChIKey of 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol?
The InChIKey is YRMPQOBGOOWQTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-2-10-9-14-6-5-12(10)13(15)8-11-4-3-7-16-11/h3-7,9,13,15H,2,8H2,1H3.
What are the key properties of 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol?
1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol has a molecular weight of 217.27 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-4-pyridinyl)-2-(furan-2-yl)ethanol is sourced from PubChem (CID 83175179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).