N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide

C17H16N4O3S2 — CID 86620407

IUPACN-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)c(-c2ccc(NS(=O)(=O)c3ccccc3)cn2)s1
InChIInChI=1S/C17H16N4O3S2/c1-11-16(25-17(19-11)20-12(2)22)15-9-8-13(10-18-15)21-26(23,24)14-6-4-3-5-7-14/h3-10,21H,1-2H3,(H,19,20,22)
InChIKeyVFVMOOMWDOTAME-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.27
Rot. Bonds5

About N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide

N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide (PubChem CID 86620407) has the molecular formula C17H16N4O3S2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
PubChem CID86620407
Molecular FormulaC17H16N4O3S2
Molecular Weight388.47 g/mol
Exact Mass388.07
IUPAC NameN-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)c(-c2ccc(NS(=O)(=O)c3ccccc3)cn2)s1
InChIInChI=1S/C17H16N4O3S2/c1-11-16(25-17(19-11)20-12(2)22)15-9-8-13(10-18-15)21-26(23,24)14-6-4-3-5-7-14/h3-10,21H,1-2H3,(H,19,20,22)
InChIKeyVFVMOOMWDOTAME-UHFFFAOYSA-N
XLogP3.27
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide with MolForge

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Related Compounds

4-[(4-fluorophenyl)sulfonylamino]-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31157378
N-[5-(benzenesulfonamido)-1,3-benzothiazol-2-yl]acetamide
CID 20971886
N-[5-(benzenesulfonamido)-2-pyridinyl]acetamide
CID 71056015
N-[5-[2-(benzenesulfonamido)-6-chloro-3-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 87177095
N-[5-[(6-phenyl-3-pyridinyl)sulfamoyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 110634809
N-[5-(benzenesulfonamido)-1,3-thiazol-2-yl]acetamide
CID 71326100
N-[5-[6-(benzenesulfonamido)-2-pyridinyl]-1,3-thiazol-2-yl]acetamide
CID 24861343
2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31156775
N-[5-[4-(benzenesulfonamido)-2-methyl-3-pyridinyl]-1,3-thiazol-2-yl]acetamide
CID 87594276
N-[5-(benzenesulfonamidocarbamoyl)-4-methyl-1,3-thiazol-2-yl]acetamide
CID 24939194
N-[5-[5-(benzenesulfonamido)-6-chloro-3-pyridinyl]-4-methyl-1,3-thiazol-2-yl]-2-phenylmethoxyacetamide
CID 86620385
N-[5-[(3-methylphenyl)sulfonylamino]-1,3-benzothiazol-2-yl]acetamide
CID 20971915

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide (CID 86620407) is N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(C)c(-c2ccc(NS(=O)(=O)c3ccccc3)cn2)s1.
What is the InChIKey of N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The InChIKey is VFVMOOMWDOTAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S2/c1-11-16(25-17(19-11)20-12(2)22)15-9-8-13(10-18-15)21-26(23,24)14-6-4-3-5-7-14/h3-10,21H,1-2H3,(H,19,20,22).
What are the key properties of N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide?
N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide has a molecular weight of 388.47 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 86620407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).