4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol

C13H7Cl2N3O2 — CID 136888723

IUPAC4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol
SMILESOc1cnccc1-c1nc(-c2cc(Cl)cc(Cl)c2)no1
InChIInChI=1S/C13H7Cl2N3O2/c14-8-3-7(4-9(15)5-8)12-17-13(20-18-12)10-1-2-16-6-11(10)19/h1-6,19H
InChIKeyNYEXLGHUUWNWBI-UHFFFAOYSA-N
MW308.12 g/mol
LogP3.81
Rot. Bonds2

About 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol

4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol (PubChem CID 136888723) has the molecular formula C13H7Cl2N3O2 and a molecular weight of 308.12 g/mol. Its IUPAC name is 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol.

Molecular Properties

Compound Name4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol
PubChem CID136888723
Molecular FormulaC13H7Cl2N3O2
Molecular Weight308.12 g/mol
Exact Mass306.99
IUPAC Name4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol
SMILESOc1cnccc1-c1nc(-c2cc(Cl)cc(Cl)c2)no1
InChIInChI=1S/C13H7Cl2N3O2/c14-8-3-7(4-9(15)5-8)12-17-13(20-18-12)10-1-2-16-6-11(10)19/h1-6,19H
InChIKeyNYEXLGHUUWNWBI-UHFFFAOYSA-N
XLogP3.81
TPSA72.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.12
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]benzene-1,2-diol
CID 136888724
2-chloro-4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136888720
2-amino-6-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136888709
5-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylphenol
CID 107918283
2-amino-4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136888710
5-(2-chloro-4-pyridinyl)-3-(3,5-dichlorophenyl)-1,2,4-oxadiazole
CID 97058010
4-[5-(3-amino-4-pyridinyl)-1,2,4-oxadiazol-3-yl]-2-fluorophenol
CID 136810076
4-[3-(diethylamino)-1,2,4-oxadiazol-5-yl]pyridin-3-ol
CID 136983449
5-(2,4-dichlorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole
CID 702922
5-(2,4-dichlorophenyl)-3-pyridin-3-yl-1,2,4-oxadiazole
CID 699599
2-methyl-4-[3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136751247
4-[5-(3,5-dichlorophenyl)-1,2,4-oxadiazol-3-yl]aniline
CID 43525094

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol?
The IUPAC name of 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol (CID 136888723) is 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol.
What is the SMILES notation for 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol?
The canonical SMILES for 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol is Oc1cnccc1-c1nc(-c2cc(Cl)cc(Cl)c2)no1.
What is the InChIKey of 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol?
The InChIKey is NYEXLGHUUWNWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl2N3O2/c14-8-3-7(4-9(15)5-8)12-17-13(20-18-12)10-1-2-16-6-11(10)19/h1-6,19H.
What are the key properties of 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol?
4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol has a molecular weight of 308.12 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3,5-dichlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-ol is sourced from PubChem (CID 136888723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).