1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol

C17H11N3O2 — CID 135429338

IUPAC1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc(-c2ccccn2)no1
InChIInChI=1S/C17H11N3O2/c21-14-9-8-11-5-1-2-6-12(11)15(14)17-19-16(20-22-17)13-7-3-4-10-18-13/h1-10,21H
InChIKeyPFTKEDZRQCTDDT-UHFFFAOYSA-N
MW289.29 g/mol
LogP3.66
Rot. Bonds2

About 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol

1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol (PubChem CID 135429338) has the molecular formula C17H11N3O2 and a molecular weight of 289.29 g/mol. Its IUPAC name is 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol
PubChem CID135429338
Molecular FormulaC17H11N3O2
Molecular Weight289.29 g/mol
Exact Mass289.09
IUPAC Name1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc(-c2ccccn2)no1
InChIInChI=1S/C17H11N3O2/c21-14-9-8-11-5-1-2-6-12(11)15(14)17-19-16(20-22-17)13-7-3-4-10-18-13/h1-10,21H
InChIKeyPFTKEDZRQCTDDT-UHFFFAOYSA-N
XLogP3.66
TPSA72.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.29
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-phenylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 838877
7-pyridin-2-yl-9-oxapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3(8),4,6,11,14,16,18,20-decaen-6-ol
CID 153291342
2-benzo[a]anthracen-7-ylpyridine
CID 154825161
5-(2-bromophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 750612
5-(2-methylsulfanylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 1484241
5-(4-ethylphenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 5346667
[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)phenyl]methanesulfonamide
CID 99839573
4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)-1,2,5-oxadiazol-3-amine
CID 62808218
2-amino-2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethanol
CID 43110252
(1S)-2-amino-1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethanol
CID 107836639
5-(6-chloro-3-pyridinyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 30028861
N-methyl-4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)aniline
CID 104698802

Frequently Asked Questions

What is the IUPAC name of 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol?
The IUPAC name of 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol (CID 135429338) is 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol.
What is the SMILES notation for 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol?
The canonical SMILES for 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol is Oc1ccc2ccccc2c1-c1nc(-c2ccccn2)no1.
What is the InChIKey of 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol?
The InChIKey is PFTKEDZRQCTDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O2/c21-14-9-8-11-5-1-2-6-12(11)15(14)17-19-16(20-22-17)13-7-3-4-10-18-13/h1-10,21H.
What are the key properties of 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol?
1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol has a molecular weight of 289.29 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)naphthalen-2-ol is sourced from PubChem (CID 135429338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).