2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide

C9H6FN3O2S — CID 103940013

IUPAC2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide
SMILESO=C(Nc1nncs1)c1ccc(O)cc1F
InChIInChI=1S/C9H6FN3O2S/c10-7-3-5(14)1-2-6(7)8(15)12-9-13-11-4-16-9/h1-4,14H,(H,12,13,15)
InChIKeyWPFQYWXPEGXJMI-UHFFFAOYSA-N
MW239.23 g/mol
LogP1.64
Rot. Bonds2

About 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide

2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide (PubChem CID 103940013) has the molecular formula C9H6FN3O2S and a molecular weight of 239.23 g/mol. Its IUPAC name is 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide
PubChem CID103940013
Molecular FormulaC9H6FN3O2S
Molecular Weight239.23 g/mol
Exact Mass239.02
IUPAC Name2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide
SMILESO=C(Nc1nncs1)c1ccc(O)cc1F
InChIInChI=1S/C9H6FN3O2S/c10-7-3-5(14)1-2-6(7)8(15)12-9-13-11-4-16-9/h1-4,14H,(H,12,13,15)
InChIKeyWPFQYWXPEGXJMI-UHFFFAOYSA-N
XLogP1.64
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-4-fluoro-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 6469162
2,4-difluoro-N-[4-oxo-4-(1,3,4-thiadiazol-2-ylamino)butyl]benzamide
CID 29370798
N-[4-[1-(ethylamino)ethyl]-1,3-thiazol-2-yl]-2-fluoro-4-hydroxybenzamide
CID 107675636
N-(2,4-difluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941207
4-bromo-N-(1,3,4-thiadiazol-2-yl)thiophene-3-carboxamide
CID 164647538
4-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-2-carboxylic acid
CID 107674896
2-fluoro-4-hydroxy-N-(3-hydroxy-4-pyridinyl)benzamide
CID 75447606
3-fluoro-4-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 55103700
2-fluoro-4-hydroxy-N-(6-methyl-3-pyridinyl)benzamide
CID 107676762
2-hydrazinyl-5-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 62510782
2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 107674901
2-fluoro-4-hydroxy-N-(5-methyl-3-pyridinyl)benzamide
CID 107676884

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide?
The IUPAC name of 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide (CID 103940013) is 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide.
What is the SMILES notation for 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide?
The canonical SMILES for 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide is O=C(Nc1nncs1)c1ccc(O)cc1F.
What is the InChIKey of 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide?
The InChIKey is WPFQYWXPEGXJMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FN3O2S/c10-7-3-5(14)1-2-6(7)8(15)12-9-13-11-4-16-9/h1-4,14H,(H,12,13,15).
What are the key properties of 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide?
2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide has a molecular weight of 239.23 g/mol, XLogP of 1.64, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-hydroxy-N-(1,3,4-thiadiazol-2-yl)benzamide is sourced from PubChem (CID 103940013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).