5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide

C16H13FN4O3 — CID 71975959

IUPAC5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
SMILESO=C(NCCc1noc(-c2ccccn2)n1)c1cc(F)ccc1O
InChIInChI=1S/C16H13FN4O3/c17-10-4-5-13(22)11(9-10)15(23)19-8-6-14-20-16(24-21-14)12-3-1-2-7-18-12/h1-5,7,9,22H,6,8H2,(H,19,23)
InChIKeyIPRUNZRXMCQPAH-UHFFFAOYSA-N
MW328.30 g/mol
LogP1.95
Rot. Bonds5

About 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide

5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide (PubChem CID 71975959) has the molecular formula C16H13FN4O3 and a molecular weight of 328.30 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
PubChem CID71975959
Molecular FormulaC16H13FN4O3
Molecular Weight328.30 g/mol
Exact Mass328.10
IUPAC Name5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
SMILESO=C(NCCc1noc(-c2ccccn2)n1)c1cc(F)ccc1O
InChIInChI=1S/C16H13FN4O3/c17-10-4-5-13(22)11(9-10)15(23)19-8-6-14-20-16(24-21-14)12-3-1-2-7-18-12/h1-5,7,9,22H,6,8H2,(H,19,23)
InChIKeyIPRUNZRXMCQPAH-UHFFFAOYSA-N
XLogP1.95
TPSA101.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.30
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 6-methyl-5-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethylcarbamoyl]pyridine-3-carboxylate
CID 154835412
1-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)propan-2-one
CID 115078766
(2S)-2-methoxy-2-phenyl-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]acetamide
CID 96999508
2-methyl-1-(2-pyridin-2-ylethyl)-3-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]guanidine
CID 111762365
5-fluoro-N-[2-(furan-2-yl)ethyl]-2-hydroxybenzamide
CID 79883377
5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide
CID 79531846
1-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]guanidine
CID 111766049
5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 67742481
4-fluoro-2-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
CID 103820316
2,4-difluoro-N-[2-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethyl]benzamide
CID 146126257
5-fluoro-2-hydroxy-N-(2-phenoxyethyl)benzamide
CID 79532175
N-[2-(3-benzyl-1,2,4-oxadiazol-5-yl)ethyl]-2,5-difluorobenzamide
CID 91763292

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide (CID 71975959) is 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide is O=C(NCCc1noc(-c2ccccn2)n1)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
The InChIKey is IPRUNZRXMCQPAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4O3/c17-10-4-5-13(22)11(9-10)15(23)19-8-6-14-20-16(24-21-14)12-3-1-2-7-18-12/h1-5,7,9,22H,6,8H2,(H,19,23).
What are the key properties of 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide?
5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide has a molecular weight of 328.30 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-[2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide is sourced from PubChem (CID 71975959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).