4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide

C20H24N2O4S — CID 86829566

IUPAC4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide
SMILESCOc1ccccc1C1(CNS(=O)(=O)c2ccc(C(N)=O)cc2)CCCC1
InChIInChI=1S/C20H24N2O4S/c1-26-18-7-3-2-6-17(18)20(12-4-5-13-20)14-22-27(24,25)16-10-8-15(9-11-16)19(21)23/h2-3,6-11,22H,4-5,12-14H2,1H3,(H2,21,23)
InChIKeyQPJRFTVQWLJJBQ-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.58
Rot. Bonds7

About 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide

4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide (PubChem CID 86829566) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide.

Molecular Properties

Compound Name4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide
PubChem CID86829566
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide
SMILESCOc1ccccc1C1(CNS(=O)(=O)c2ccc(C(N)=O)cc2)CCCC1
InChIInChI=1S/C20H24N2O4S/c1-26-18-7-3-2-6-17(18)20(12-4-5-13-20)14-22-27(24,25)16-10-8-15(9-11-16)19(21)23/h2-3,6-11,22H,4-5,12-14H2,1H3,(H2,21,23)
InChIKeyQPJRFTVQWLJJBQ-UHFFFAOYSA-N
XLogP2.58
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1-phenylcyclohexyl)methylsulfamoyl]benzamide
CID 46457755
methyl N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]carbamate
CID 110477745
N-[[1-(3,4-dimethoxyphenyl)cyclopentyl]methyl]benzenesulfonamide
CID 1114580
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
CID 110441312
4-methoxy-N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]-3,5-dimethylbenzenesulfonamide
CID 27451012
4-fluoro-N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]-3-methylbenzenesulfonamide
CID 27450995
N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 110444850
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-2-oxopropanamide
CID 110478355
1,1-diethyl-3-[[1-(2-methoxyphenyl)cyclopentyl]methyl]urea
CID 110445118
4-[[1-(2-methoxyphenyl)cyclopentyl]methylamino]piperidine-1-carboxamide
CID 75427727
2-methoxy-N-[(1-phenylcyclopentyl)methyl]benzenesulfonamide
CID 55477227
N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]methanesulfonamide
CID 47388317

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide?
The IUPAC name of 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide (CID 86829566) is 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide.
What is the SMILES notation for 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide?
The canonical SMILES for 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide is COc1ccccc1C1(CNS(=O)(=O)c2ccc(C(N)=O)cc2)CCCC1.
What is the InChIKey of 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide?
The InChIKey is QPJRFTVQWLJJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-26-18-7-3-2-6-17(18)20(12-4-5-13-20)14-22-27(24,25)16-10-8-15(9-11-16)19(21)23/h2-3,6-11,22H,4-5,12-14H2,1H3,(H2,21,23).
What are the key properties of 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide?
4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide has a molecular weight of 388.49 g/mol, XLogP of 2.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(2-methoxyphenyl)cyclopentyl]methylsulfamoyl]benzamide is sourced from PubChem (CID 86829566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).