2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide

C13H14N2O2S — CID 54990504

IUPAC2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide
SMILESCc1cccc(C(=O)N(C)Cc2cscn2)c1O
InChIInChI=1S/C13H14N2O2S/c1-9-4-3-5-11(12(9)16)13(17)15(2)6-10-7-18-8-14-10/h3-5,7-8,16H,6H2,1-2H3
InChIKeyCXDCNUNZLDNNMV-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.43
Rot. Bonds3

About 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide

2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide (PubChem CID 54990504) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide
PubChem CID54990504
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide
SMILESCc1cccc(C(=O)N(C)Cc2cscn2)c1O
InChIInChI=1S/C13H14N2O2S/c1-9-4-3-5-11(12(9)16)13(17)15(2)6-10-7-18-8-14-10/h3-5,7-8,16H,6H2,1-2H3
InChIKeyCXDCNUNZLDNNMV-UHFFFAOYSA-N
XLogP2.43
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-2-hydroxy-N-methyl-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 103829866
N-methyl-2-(propylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
CID 62179926
2-[2-[methyl(1,3-thiazol-4-ylmethyl)carbamoyl]phenyl]sulfanylpropanoic acid
CID 119182649
2-hydroxy-N,3-dimethyl-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide
CID 64512827
2-bromo-N-methyl-N-(1,3-thiazol-4-ylmethyl)furan-3-carboxamide
CID 106853803
4-amino-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 55013339
4-fluoro-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 55163854
2-hydroxy-N-methyl-4-nitro-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 86797945
2-[2-[methyl(1,3-thiazol-4-ylmethyl)amino]-2-oxoethyl]benzoic acid
CID 115923742
N-methyl-N-(pyridin-4-ylmethyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide
CID 86845687
3-amino-5-bromo-N,2-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 107872599
2-hydroxy-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 61380836

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide?
The IUPAC name of 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide (CID 54990504) is 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide.
What is the SMILES notation for 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide?
The canonical SMILES for 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide is Cc1cccc(C(=O)N(C)Cc2cscn2)c1O.
What is the InChIKey of 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide?
The InChIKey is CXDCNUNZLDNNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-9-4-3-5-11(12(9)16)13(17)15(2)6-10-7-18-8-14-10/h3-5,7-8,16H,6H2,1-2H3.
What are the key properties of 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide?
2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide has a molecular weight of 262.33 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)benzamide is sourced from PubChem (CID 54990504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).