1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol

C13H11Cl2NO — CID 113446836

IUPAC1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol
SMILESOC(Cc1cccnc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H11Cl2NO/c14-11-5-10(6-12(15)7-11)13(17)4-9-2-1-3-16-8-9/h1-3,5-8,13,17H,4H2
InChIKeyLXUDLQXXMNAWEG-UHFFFAOYSA-N
MW268.14 g/mol
LogP3.66
Rot. Bonds3

About 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol

1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol (PubChem CID 113446836) has the molecular formula C13H11Cl2NO and a molecular weight of 268.14 g/mol. Its IUPAC name is 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol.

Molecular Properties

Compound Name1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol
PubChem CID113446836
Molecular FormulaC13H11Cl2NO
Molecular Weight268.14 g/mol
Exact Mass267.02
IUPAC Name1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol
SMILESOC(Cc1cccnc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H11Cl2NO/c14-11-5-10(6-12(15)7-11)13(17)4-9-2-1-3-16-8-9/h1-3,5-8,13,17H,4H2
InChIKeyLXUDLQXXMNAWEG-UHFFFAOYSA-N
XLogP3.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.14
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-iodophenyl)-2-pyridin-3-ylethanol
CID 115832159
1-[4-(difluoromethyl)phenyl]-2-pyridin-3-ylethanol
CID 104735818
1-[3-(difluoromethyl)phenyl]-2-pyridin-3-ylethanol
CID 113446855
1-naphthalen-2-yl-2-pyridin-3-ylethanol
CID 62790666
1-(3-bromo-5-fluorophenyl)-2-pyridin-3-ylethanol
CID 104736133
(3,5-dichlorophenyl)-pyridin-3-ylmethanol
CID 63900537
1-(4-phenylphenyl)-2-pyridin-3-ylethanol
CID 65455131
2-(4-chlorophenyl)-1-(3,5-dichlorophenyl)ethanol
CID 63519476
1-(6-methyl-3-pyridinyl)-2-pyridin-3-ylethanol
CID 63155414
1-[4-(2-methylpropyl)phenyl]-2-pyridin-3-ylethanol
CID 104735785
1-(3-chloro-2-pyridinyl)-2-pyridin-3-ylethanol
CID 103443598
(1R)-2-phenyl-1-pyridin-3-ylethanol
CID 93312258

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol?
The IUPAC name of 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol (CID 113446836) is 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol.
What is the SMILES notation for 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol?
The canonical SMILES for 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol is OC(Cc1cccnc1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol?
The InChIKey is LXUDLQXXMNAWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO/c14-11-5-10(6-12(15)7-11)13(17)4-9-2-1-3-16-8-9/h1-3,5-8,13,17H,4H2.
What are the key properties of 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol?
1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol has a molecular weight of 268.14 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichlorophenyl)-2-pyridin-3-ylethanol is sourced from PubChem (CID 113446836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).