N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide

C19H30N2O4S — CID 4820427

IUPACN-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C2CCCC2)c1
InChIInChI=1S/C19H30N2O4S/c1-5-21(6-2)26(23,24)16-11-12-18(25-14(3)4)17(13-16)20-19(22)15-9-7-8-10-15/h11-15H,5-10H2,1-4H3,(H,20,22)
InChIKeyDJFSLCXEBZBJAR-UHFFFAOYSA-N
MW382.53 g/mol
LogP3.63
Rot. Bonds8

About N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide

N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide (PubChem CID 4820427) has the molecular formula C19H30N2O4S and a molecular weight of 382.53 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide
PubChem CID4820427
Molecular FormulaC19H30N2O4S
Molecular Weight382.53 g/mol
Exact Mass382.19
IUPAC NameN-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C2CCCC2)c1
InChIInChI=1S/C19H30N2O4S/c1-5-21(6-2)26(23,24)16-11-12-18(25-14(3)4)17(13-16)20-19(22)15-9-7-8-10-15/h11-15H,5-10H2,1-4H3,(H,20,22)
InChIKeyDJFSLCXEBZBJAR-UHFFFAOYSA-N
XLogP3.63
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide (CID 4820427) is N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide is CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C2CCCC2)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide?
The InChIKey is DJFSLCXEBZBJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O4S/c1-5-21(6-2)26(23,24)16-11-12-18(25-14(3)4)17(13-16)20-19(22)15-9-7-8-10-15/h11-15H,5-10H2,1-4H3,(H,20,22).
What are the key properties of N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide?
N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide has a molecular weight of 382.53 g/mol, XLogP of 3.63, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopentanecarboxamide is sourced from PubChem (CID 4820427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).