N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide

C14H15ClN4O4S — CID 1114631

IUPACN-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide
SMILESCOc1nc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)nc(C)c1Cl
InChIInChI=1S/C14H15ClN4O4S/c1-8-12(15)13(23-3)18-14(16-8)19-24(21,22)11-6-4-10(5-7-11)17-9(2)20/h4-7H,1-3H3,(H,17,20)(H,16,18,19)
InChIKeyWMLLRESRUDXXJL-UHFFFAOYSA-N
MW370.82 g/mol
LogP2.21
Rot. Bonds5

About N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide

N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide (PubChem CID 1114631) has the molecular formula C14H15ClN4O4S and a molecular weight of 370.82 g/mol. Its IUPAC name is N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide
PubChem CID1114631
Molecular FormulaC14H15ClN4O4S
Molecular Weight370.82 g/mol
Exact Mass370.05
IUPAC NameN-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide
SMILESCOc1nc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)nc(C)c1Cl
InChIInChI=1S/C14H15ClN4O4S/c1-8-12(15)13(23-3)18-14(16-8)19-24(21,22)11-6-4-10(5-7-11)17-9(2)20/h4-7H,1-3H3,(H,17,20)(H,16,18,19)
InChIKeyWMLLRESRUDXXJL-UHFFFAOYSA-N
XLogP2.21
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.82
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-(((4,6-Dimethoxy-2-pyrimidinyl)amino)sulfonyl)phenyl)acetamide
CID 168167
N4-Acetylsulfadimethoxine
CID 473359
2-chloro-N-(4-methoxy-6-methylpyrimidin-2-yl)benzenesulfonamide
CID 742822
N-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)-4-methylbenzenesulfonamide
CID 658027
N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}hexanamide
CID 2252316
N-[4-({4-[(2,6-Dimethoxypyrimidin-4-YL)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide
CID 3110772
2-[(5-Chloro-4-methoxy-6-methyl-2-pyrimidinyl)(phenylsulfonyl)amino]acetamide
CID 4121354
N-(4-methoxy-6-methylpyrimidin-2-yl)benzenesulfonamide
CID 778472
Methyl {4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamate
CID 983343
N-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]butanamide
CID 1010926
4-(3-(3-chlorophenyl)ureido)-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide
CID 1226686
N(4)-Acetylsulfamonomethoxine
CID 160729

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide (CID 1114631) is N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide is COc1nc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)nc(C)c1Cl.
What is the InChIKey of N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is WMLLRESRUDXXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN4O4S/c1-8-12(15)13(23-3)18-14(16-8)19-24(21,22)11-6-4-10(5-7-11)17-9(2)20/h4-7H,1-3H3,(H,17,20)(H,16,18,19).
What are the key properties of N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide?
N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 370.82 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 1114631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).