2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide

C11H10N2O3S — CID 113346793

IUPAC2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide
SMILESO=C(NCc1nccs1)c1c(O)cccc1O
InChIInChI=1S/C11H10N2O3S/c14-7-2-1-3-8(15)10(7)11(16)13-6-9-12-4-5-17-9/h1-5,14-15H,6H2,(H,13,16)
InChIKeyLZIPXTWYTKELTB-UHFFFAOYSA-N
MW250.28 g/mol
LogP1.48
Rot. Bonds3

About 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide

2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide (PubChem CID 113346793) has the molecular formula C11H10N2O3S and a molecular weight of 250.28 g/mol. Its IUPAC name is 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide
PubChem CID113346793
Molecular FormulaC11H10N2O3S
Molecular Weight250.28 g/mol
Exact Mass250.04
IUPAC Name2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide
SMILESO=C(NCc1nccs1)c1c(O)cccc1O
InChIInChI=1S/C11H10N2O3S/c14-7-2-1-3-8(15)10(7)11(16)13-6-9-12-4-5-17-9/h1-5,14-15H,6H2,(H,13,16)
InChIKeyLZIPXTWYTKELTB-UHFFFAOYSA-N
XLogP1.48
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 51.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-nitro-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 110463662
2-hydroxy-3-nitro-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 103800073
6-chloro-N-(1,3-thiazol-2-ylmethyl)pyridine-2-carboxamide
CID 62234229
6-methyl-N-(1,3-thiazol-2-ylmethyl)pyridine-2-carboxamide
CID 110462485
6-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-pyridine-2-carboxamide
CID 107261797
5-bromo-2-hydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 103616957
4-(1,3-thiazol-2-ylmethylcarbamoyl)benzoic acid
CID 54962478
2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110442320
2-sulfanyl-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 107025613
4-bromo-3-hydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 103872542
4-bromo-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 60773800
2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110463122

Frequently Asked Questions

What is the IUPAC name of 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide?
The IUPAC name of 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide (CID 113346793) is 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide.
What is the SMILES notation for 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide?
The canonical SMILES for 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide is O=C(NCc1nccs1)c1c(O)cccc1O.
What is the InChIKey of 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide?
The InChIKey is LZIPXTWYTKELTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3S/c14-7-2-1-3-8(15)10(7)11(16)13-6-9-12-4-5-17-9/h1-5,14-15H,6H2,(H,13,16).
What are the key properties of 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide?
2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide has a molecular weight of 250.28 g/mol, XLogP of 1.48, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide is sourced from PubChem (CID 113346793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).