4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide

C12H12N2O2S — CID 60709490

IUPAC4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
SMILESCc1csc(CNC(=O)c2ccc(O)cc2)n1
InChIInChI=1S/C12H12N2O2S/c1-8-7-17-11(14-8)6-13-12(16)9-2-4-10(15)5-3-9/h2-5,7,15H,6H2,1H3,(H,13,16)
InChIKeyQQOBHUGRCXCZCF-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.09
Rot. Bonds3

About 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide

4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide (PubChem CID 60709490) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
PubChem CID60709490
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Name4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
SMILESCc1csc(CNC(=O)c2ccc(O)cc2)n1
InChIInChI=1S/C12H12N2O2S/c1-8-7-17-11(14-8)6-13-12(16)9-2-4-10(15)5-3-9/h2-5,7,15H,6H2,1H3,(H,13,16)
InChIKeyQQOBHUGRCXCZCF-UHFFFAOYSA-N
XLogP2.09
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-4-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 60709417
5-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide
CID 63858903
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-propan-2-ylsulfonylbenzamide
CID 47048130
5-[(4-methyl-1,3-thiazol-2-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 60725191
4-(dimethylsulfamoyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 51315975
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 51291464
4-bromo-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-3-(trifluoromethyl)benzamide
CID 81448940
methyl 2-[[4-[(4-methyl-1,3-thiazol-2-yl)methylcarbamoylamino]benzoyl]amino]acetate
CID 55699116
4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62307538
5-[(4-methyl-1,3-thiazol-2-yl)methylcarbamoyl]thiophene-2-carboxylic acid
CID 60722044
N-[[4-(4-hydroxyphenyl)-1,3-thiazol-2-yl]methyl]pyridine-4-carboxamide
CID 110393681
2-hydrazinyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-4-carboxamide
CID 62247850

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide?
The IUPAC name of 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide (CID 60709490) is 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide?
The canonical SMILES for 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide is Cc1csc(CNC(=O)c2ccc(O)cc2)n1.
What is the InChIKey of 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide?
The InChIKey is QQOBHUGRCXCZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-8-7-17-11(14-8)6-13-12(16)9-2-4-10(15)5-3-9/h2-5,7,15H,6H2,1H3,(H,13,16).
What are the key properties of 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide?
4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide has a molecular weight of 248.31 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide is sourced from PubChem (CID 60709490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).