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

C11H10N2OS — CID 576955

IUPAC4-methyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nccs2)cc1
InChIInChI=1S/C11H10N2OS/c1-8-2-4-9(5-3-8)10(14)13-11-12-6-7-15-11/h2-7H,1H3,(H,12,13,14)
InChIKeyXLNBGXSUYFKJFF-UHFFFAOYSA-N
MW218.28 g/mol
LogP2.70
Rot. Bonds2

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

4-methyl-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 576955) has the molecular formula C11H10N2OS and a molecular weight of 218.28 g/mol. Its IUPAC name is 4-methyl-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-methyl-N-(1,3-thiazol-2-yl)benzamide
PubChem CID576955
Molecular FormulaC11H10N2OS
Molecular Weight218.28 g/mol
Exact Mass218.05
IUPAC Name4-methyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nccs2)cc1
InChIInChI=1S/C11H10N2OS/c1-8-2-4-9(5-3-8)10(14)13-11-12-6-7-15-11/h2-7H,1H3,(H,12,13,14)
InChIKeyXLNBGXSUYFKJFF-UHFFFAOYSA-N
XLogP2.70
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-methyl-N-(1,3-thiazol-2-yl)benzamide (CID 576955) is 4-methyl-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-methyl-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-methyl-N-(1,3-thiazol-2-yl)benzamide is Cc1ccc(C(=O)Nc2nccs2)cc1.
What is the InChIKey of 4-methyl-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is XLNBGXSUYFKJFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2OS/c1-8-2-4-9(5-3-8)10(14)13-11-12-6-7-15-11/h2-7H,1H3,(H,12,13,14).
What are the key properties of 4-methyl-N-(1,3-thiazol-2-yl)benzamide?
4-methyl-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 218.28 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 576955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).