N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide

C15H21ClN2O3S — CID 71974929

IUPACN-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide
SMILESCNS(=O)(=O)CC(=O)NCC1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C15H21ClN2O3S/c1-17-22(20,21)10-14(19)18-11-15(8-2-3-9-15)12-4-6-13(16)7-5-12/h4-7,17H,2-3,8-11H2,1H3,(H,18,19)
InChIKeySHISRYDJZRCKHV-UHFFFAOYSA-N
MW344.86 g/mol
LogP1.82
Rot. Bonds6

About N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide

N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide (PubChem CID 71974929) has the molecular formula C15H21ClN2O3S and a molecular weight of 344.86 g/mol. Its IUPAC name is N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide.

Molecular Properties

Compound NameN-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide
PubChem CID71974929
Molecular FormulaC15H21ClN2O3S
Molecular Weight344.86 g/mol
Exact Mass344.10
IUPAC NameN-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide
SMILESCNS(=O)(=O)CC(=O)NCC1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C15H21ClN2O3S/c1-17-22(20,21)10-14(19)18-11-15(8-2-3-9-15)12-4-6-13(16)7-5-12/h4-7,17H,2-3,8-11H2,1H3,(H,18,19)
InChIKeySHISRYDJZRCKHV-UHFFFAOYSA-N
XLogP1.82
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.86
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide?
The IUPAC name of N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide (CID 71974929) is N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide.
What is the SMILES notation for N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide?
The canonical SMILES for N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide is CNS(=O)(=O)CC(=O)NCC1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide?
The InChIKey is SHISRYDJZRCKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O3S/c1-17-22(20,21)10-14(19)18-11-15(8-2-3-9-15)12-4-6-13(16)7-5-12/h4-7,17H,2-3,8-11H2,1H3,(H,18,19).
What are the key properties of N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide?
N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide has a molecular weight of 344.86 g/mol, XLogP of 1.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-chlorophenyl)cyclopentyl]methyl]-2-(methylsulfamoyl)acetamide is sourced from PubChem (CID 71974929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).