2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide

C11H11ClN4O3S — CID 63000377

IUPAC2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
SMILESCc1ncc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)[nH]1
InChIInChI=1S/C11H11ClN4O3S/c1-6-14-5-10(15-6)20(18,19)16-7-2-3-9(12)8(4-7)11(13)17/h2-5,16H,1H3,(H2,13,17)(H,14,15)
InChIKeyULFMZUXDAPTMAH-UHFFFAOYSA-N
MW314.75 g/mol
LogP1.27
Rot. Bonds4

About 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide

2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide (PubChem CID 63000377) has the molecular formula C11H11ClN4O3S and a molecular weight of 314.75 g/mol. Its IUPAC name is 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide.

Molecular Properties

Compound Name2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
PubChem CID63000377
Molecular FormulaC11H11ClN4O3S
Molecular Weight314.75 g/mol
Exact Mass314.02
IUPAC Name2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
SMILESCc1ncc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)[nH]1
InChIInChI=1S/C11H11ClN4O3S/c1-6-14-5-10(15-6)20(18,19)16-7-2-3-9(12)8(4-7)11(13)17/h2-5,16H,1H3,(H2,13,17)(H,14,15)
InChIKeyULFMZUXDAPTMAH-UHFFFAOYSA-N
XLogP1.27
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.75
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-methyl-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
CID 62999870
N-(3-chloro-4-hydroxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64786558
N-(3-hydroxy-4-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64794398
2-[3-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]phenoxy]acetamide
CID 63000197
N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62998345
2-methyl-N-quinoxalin-6-yl-1H-imidazole-5-sulfonamide
CID 63000218
3-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzoic acid
CID 62999270
N'-hydroxy-4-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzenecarboximidamide
CID 77021130
2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 63000163
N-methyl-4-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
CID 62997996
N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62997984
3-chloro-N'-hydroxy-4-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzenecarboximidamide
CID 107810033

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide?
The IUPAC name of 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide (CID 63000377) is 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide.
What is the SMILES notation for 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide?
The canonical SMILES for 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide is Cc1ncc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)[nH]1.
What is the InChIKey of 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide?
The InChIKey is ULFMZUXDAPTMAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4O3S/c1-6-14-5-10(15-6)20(18,19)16-7-2-3-9(12)8(4-7)11(13)17/h2-5,16H,1H3,(H2,13,17)(H,14,15).
What are the key properties of 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide?
2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide has a molecular weight of 314.75 g/mol, XLogP of 1.27, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide is sourced from PubChem (CID 63000377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).