N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide

C18H29N3O3S — CID 55666017

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)NCC2(N(C)C)CCCC2)cc(C)c1C
InChIInChI=1S/C18H29N3O3S/c1-13-10-15(11-16(14(13)2)25(23,24)19-3)17(22)20-12-18(21(4)5)8-6-7-9-18/h10-11,19H,6-9,12H2,1-5H3,(H,20,22)
InChIKeyANOMLUIMOLLZJJ-UHFFFAOYSA-N
MW367.52 g/mol
LogP1.82
Rot. Bonds6

About N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide

N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide (PubChem CID 55666017) has the molecular formula C18H29N3O3S and a molecular weight of 367.52 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide
PubChem CID55666017
Molecular FormulaC18H29N3O3S
Molecular Weight367.52 g/mol
Exact Mass367.19
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)NCC2(N(C)C)CCCC2)cc(C)c1C
InChIInChI=1S/C18H29N3O3S/c1-13-10-15(11-16(14(13)2)25(23,24)19-3)17(22)20-12-18(21(4)5)8-6-7-9-18/h10-11,19H,6-9,12H2,1-5H3,(H,20,22)
InChIKeyANOMLUIMOLLZJJ-UHFFFAOYSA-N
XLogP1.82
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.52
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethyl-5-(methylsulfamoyl)-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 24571384
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide
CID 55746120
3,4-dimethyl-N-(2-methylpropyl)-5-(methylsulfamoyl)benzamide
CID 27539196
N-(2-hydroxypropyl)-3,4-dimethyl-5-(methylsulfamoyl)benzamide
CID 78856270
3,4-dimethyl-5-(methylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide
CID 51180585
3,4-dimethyl-5-(methylsulfamoyl)-N-pentylbenzamide
CID 17476236
5-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-2,4-dimethylbenzamide
CID 102705855
N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4,5-trimethoxybenzamide
CID 39915609
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 55735491
N-[[1-(dimethylamino)cycloheptyl]methyl]-3-methyl-4-nitrobenzamide
CID 16960831
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-hydroxy-4-iodobenzamide
CID 104627729
3-(cyclopropylsulfamoyl)-N-[[1-(dimethylamino)cycloheptyl]methyl]-4-methoxybenzamide
CID 18155370

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide (CID 55666017) is N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1cc(C(=O)NCC2(N(C)C)CCCC2)cc(C)c1C.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide?
The InChIKey is ANOMLUIMOLLZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O3S/c1-13-10-15(11-16(14(13)2)25(23,24)19-3)17(22)20-12-18(21(4)5)8-6-7-9-18/h10-11,19H,6-9,12H2,1-5H3,(H,20,22).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide?
N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide has a molecular weight of 367.52 g/mol, XLogP of 1.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-3,4-dimethyl-5-(methylsulfamoyl)benzamide is sourced from PubChem (CID 55666017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).