(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol

C15H16ClNO2 — CID 83124719

IUPAC(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol
SMILESCc1cc(Cl)cc(C)c1Oc1ccc([C@@H](C)O)nc1
InChIInChI=1S/C15H16ClNO2/c1-9-6-12(16)7-10(2)15(9)19-13-4-5-14(11(3)18)17-8-13/h4-8,11,18H,1-3H3/t11-/m1/s1
InChIKeyHTDCLNRRJZKXQR-LLVKDONJSA-N
MW277.75 g/mol
LogP4.20
Rot. Bonds3

About (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol

(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol (PubChem CID 83124719) has the molecular formula C15H16ClNO2 and a molecular weight of 277.75 g/mol. Its IUPAC name is (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol
PubChem CID83124719
Molecular FormulaC15H16ClNO2
Molecular Weight277.75 g/mol
Exact Mass277.09
IUPAC Name(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol
SMILESCc1cc(Cl)cc(C)c1Oc1ccc([C@@H](C)O)nc1
InChIInChI=1S/C15H16ClNO2/c1-9-6-12(16)7-10(2)15(9)19-13-4-5-14(11(3)18)17-8-13/h4-8,11,18H,1-3H3/t11-/m1/s1
InChIKeyHTDCLNRRJZKXQR-LLVKDONJSA-N
XLogP4.20
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol (CID 83124719) is (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol is Cc1cc(Cl)cc(C)c1Oc1ccc([C@@H](C)O)nc1.
What is the InChIKey of (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol?
The InChIKey is HTDCLNRRJZKXQR-LLVKDONJSA-N. The full InChI is InChI=1S/C15H16ClNO2/c1-9-6-12(16)7-10(2)15(9)19-13-4-5-14(11(3)18)17-8-13/h4-8,11,18H,1-3H3/t11-/m1/s1.
What are the key properties of (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol?
(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol has a molecular weight of 277.75 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol is sourced from PubChem (CID 83124719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).