4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide

C22H28N2O4S — CID 55606378

IUPAC4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide
SMILESCC(C)N(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)cc1
InChIInChI=1S/C22H28N2O4S/c1-16(2)24(3)29(26,27)21-14-10-18(11-15-21)23-22(25)17-8-12-20(13-9-17)28-19-6-4-5-7-19/h8-16,19H,4-7H2,1-3H3,(H,23,25)
InChIKeyQLRCGHLFSPZQBM-UHFFFAOYSA-N
MW416.54 g/mol
LogP4.29
Rot. Bonds7

About 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide

4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide (PubChem CID 55606378) has the molecular formula C22H28N2O4S and a molecular weight of 416.54 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide
PubChem CID55606378
Molecular FormulaC22H28N2O4S
Molecular Weight416.54 g/mol
Exact Mass416.18
IUPAC Name4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide
SMILESCC(C)N(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)cc1
InChIInChI=1S/C22H28N2O4S/c1-16(2)24(3)29(26,27)21-14-10-18(11-15-21)23-22(25)17-8-12-20(13-9-17)28-19-6-4-5-7-19/h8-16,19H,4-7H2,1-3H3,(H,23,25)
InChIKeyQLRCGHLFSPZQBM-UHFFFAOYSA-N
XLogP4.29
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.54
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyclopentyloxyphenyl)-4-(methylsulfamoyl)benzamide
CID 38455287
N-(4-cyclopentyloxyphenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 36566720
N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
CID 36565370
4-cyclopentyloxy-N-(4-methylsulfanylphenyl)benzamide
CID 39100305
N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55869873
4-[cyclopentyl(methyl)sulfamoyl]-N-(4-fluorophenyl)benzamide
CID 7656086
N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 51297168
4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 7656046
N-(4-cyclopentyloxyphenyl)pyridine-4-carboxamide;hydrochloride
CID 110777040
3,4-dichloro-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide
CID 8759609
N-(3-methoxyphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 41363704
N-(3,5-dichlorophenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 44993166

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide (CID 55606378) is 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide is CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide?
The InChIKey is QLRCGHLFSPZQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4S/c1-16(2)24(3)29(26,27)21-14-10-18(11-15-21)23-22(25)17-8-12-20(13-9-17)28-19-6-4-5-7-19/h8-16,19H,4-7H2,1-3H3,(H,23,25).
What are the key properties of 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide?
4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide has a molecular weight of 416.54 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 55606378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).