2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol

C15H18N2O2 — CID 114937798

IUPAC2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol
SMILESCCc1ccc(CC(O)c2ccc(OC)nc2)nc1
InChIInChI=1S/C15H18N2O2/c1-3-11-4-6-13(16-9-11)8-14(18)12-5-7-15(19-2)17-10-12/h4-7,9-10,14,18H,3,8H2,1-2H3
InChIKeyFKQUXIHQZSTZNP-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.32
Rot. Bonds5

About 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol

2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol (PubChem CID 114937798) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol
PubChem CID114937798
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol
SMILESCCc1ccc(CC(O)c2ccc(OC)nc2)nc1
InChIInChI=1S/C15H18N2O2/c1-3-11-4-6-13(16-9-11)8-14(18)12-5-7-15(19-2)17-10-12/h4-7,9-10,14,18H,3,8H2,1-2H3
InChIKeyFKQUXIHQZSTZNP-UHFFFAOYSA-N
XLogP2.32
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol?
The IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol (CID 114937798) is 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol.
What is the SMILES notation for 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol?
The canonical SMILES for 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol is CCc1ccc(CC(O)c2ccc(OC)nc2)nc1.
What is the InChIKey of 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol?
The InChIKey is FKQUXIHQZSTZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-11-4-6-13(16-9-11)8-14(18)12-5-7-15(19-2)17-10-12/h4-7,9-10,14,18H,3,8H2,1-2H3.
What are the key properties of 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol?
2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol has a molecular weight of 258.32 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-pyridinyl)-1-(6-methoxy-3-pyridinyl)ethanol is sourced from PubChem (CID 114937798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).