3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide

C22H24N4O5S — CID 55700493

IUPAC3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C22H24N4O5S/c1-14-23-21(25-31-14)17-9-5-6-10-18(17)24-22(27)15-11-12-19(30-2)20(13-15)32(28,29)26-16-7-3-4-8-16/h5-6,9-13,16,26H,3-4,7-8H2,1-2H3,(H,24,27)
InChIKeySOYHQLRXXCMEJV-UHFFFAOYSA-N
MW456.52 g/mol
LogP3.53
Rot. Bonds7

About 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide

3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide (PubChem CID 55700493) has the molecular formula C22H24N4O5S and a molecular weight of 456.52 g/mol. Its IUPAC name is 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
PubChem CID55700493
Molecular FormulaC22H24N4O5S
Molecular Weight456.52 g/mol
Exact Mass456.15
IUPAC Name3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C22H24N4O5S/c1-14-23-21(25-31-14)17-9-5-6-10-18(17)24-22(27)15-11-12-19(30-2)20(13-15)32(28,29)26-16-7-3-4-8-16/h5-6,9-13,16,26H,3-4,7-8H2,1-2H3,(H,24,27)
InChIKeySOYHQLRXXCMEJV-UHFFFAOYSA-N
XLogP3.53
TPSA123.42 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.52
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-bromophenyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 26536733
3-(cyclopentylsulfamoyl)-N-(2,3-dimethylphenyl)-4-methoxybenzamide
CID 26915050
3-(cyclopentylsulfamoyl)-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 35031433
3-(cyclopentylsulfamoyl)-N-[2,6-di(propan-2-yl)phenyl]-4-methoxybenzamide
CID 26102322
4-bromo-3-(dimethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 55700495
N-(3-bromophenyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 29435478
methyl 5-[[3-(cyclopentylsulfamoyl)-4-methoxybenzoyl]amino]-2,4-difluorobenzoate
CID 38201593
N-[3,5-bis(trifluoromethyl)phenyl]-3-(cyclohexylsulfamoyl)-4-methoxybenzamide
CID 100795505
N-(6-amino-3-pyridinyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 119515378
N-(5-amino-2-methylphenyl)-3-(cyclopropylsulfamoyl)-4-methoxybenzamide
CID 120569275
3-(cyclopentylsulfamoyl)-4-methoxy-N-(4-methylcyclohexyl)benzamide
CID 2579929
3-(cyclobutylsulfamoyl)-4-methoxybenzoic acid
CID 55067218

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
The IUPAC name of 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide (CID 55700493) is 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide.
What is the SMILES notation for 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
The canonical SMILES for 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide is COc1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1S(=O)(=O)NC1CCCC1.
What is the InChIKey of 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
The InChIKey is SOYHQLRXXCMEJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O5S/c1-14-23-21(25-31-14)17-9-5-6-10-18(17)24-22(27)15-11-12-19(30-2)20(13-15)32(28,29)26-16-7-3-4-8-16/h5-6,9-13,16,26H,3-4,7-8H2,1-2H3,(H,24,27).
What are the key properties of 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide has a molecular weight of 456.52 g/mol, XLogP of 3.53, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide is sourced from PubChem (CID 55700493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).