(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol

C13H14N2O2 — CID 83125304

IUPAC(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol
SMILESCc1ncccc1Oc1ccc([C@@H](C)O)nc1
InChIInChI=1S/C13H14N2O2/c1-9-13(4-3-7-14-9)17-11-5-6-12(10(2)16)15-8-11/h3-8,10,16H,1-2H3/t10-/m1/s1
InChIKeyCNOIVTOILHSTBJ-SNVBAGLBSA-N
MW230.27 g/mol
LogP2.63
Rot. Bonds3

About (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol

(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol (PubChem CID 83125304) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol
PubChem CID83125304
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol
SMILESCc1ncccc1Oc1ccc([C@@H](C)O)nc1
InChIInChI=1S/C13H14N2O2/c1-9-13(4-3-7-14-9)17-11-5-6-12(10(2)16)15-8-11/h3-8,10,16H,1-2H3/t10-/m1/s1
InChIKeyCNOIVTOILHSTBJ-SNVBAGLBSA-N
XLogP2.63
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol (CID 83125304) is (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol is Cc1ncccc1Oc1ccc([C@@H](C)O)nc1.
What is the InChIKey of (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol?
The InChIKey is CNOIVTOILHSTBJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9-13(4-3-7-14-9)17-11-5-6-12(10(2)16)15-8-11/h3-8,10,16H,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol?
(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol has a molecular weight of 230.27 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol is sourced from PubChem (CID 83125304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).