N-cyclopropyl-3-(pentylsulfamoyl)benzamide

C15H22N2O3S — CID 109062314

IUPACN-cyclopropyl-3-(pentylsulfamoyl)benzamide
SMILESCCCCCNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C15H22N2O3S/c1-2-3-4-10-16-21(19,20)14-7-5-6-12(11-14)15(18)17-13-8-9-13/h5-7,11,13,16H,2-4,8-10H2,1H3,(H,17,18)
InChIKeyDBJYMKZAXNYAQM-UHFFFAOYSA-N
MW310.42 g/mol
LogP2.05
Rot. Bonds8

About N-cyclopropyl-3-(pentylsulfamoyl)benzamide

N-cyclopropyl-3-(pentylsulfamoyl)benzamide (PubChem CID 109062314) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-cyclopropyl-3-(pentylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(pentylsulfamoyl)benzamide
PubChem CID109062314
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-cyclopropyl-3-(pentylsulfamoyl)benzamide
SMILESCCCCCNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C15H22N2O3S/c1-2-3-4-10-16-21(19,20)14-7-5-6-12(11-14)15(18)17-13-8-9-13/h5-7,11,13,16H,2-4,8-10H2,1H3,(H,17,18)
InChIKeyDBJYMKZAXNYAQM-UHFFFAOYSA-N
XLogP2.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-cyclopropyl-3-(pentylsulfamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-3-(methylsulfamoyl)benzamide
CID 35743549
N-(oxolan-2-ylmethyl)-3-(pentylsulfamoyl)benzamide
CID 109063938
3-[2-(3-chlorophenyl)ethylsulfamoyl]-N-cyclopropylbenzamide
CID 109062317
3-(benzylsulfamoyl)-N-cyclopropylbenzamide
CID 9165600
N-(3-methylbutyl)-3-(pentylsulfamoyl)benzamide
CID 109065314
4-[[3-(2-methoxyethylsulfamoyl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119230330
ethyl 4-[[3-(propylsulfamoyl)benzoyl]amino]piperidine-1-carboxylate
CID 109061890
N-cycloheptyl-3-[2-(dimethylamino)ethylsulfamoyl]benzamide
CID 109063994
N,N-diethyl-3-(pentylsulfamoyl)benzamide
CID 109065070
3-(ethylsulfamoyl)-N-hexylbenzamide
CID 46538065
N-cyclopropyl-3-methylsulfonylbenzamide
CID 18105935
N-cyclopropyl-3-[(4-ethylphenyl)sulfamoyl]benzamide
CID 109062324

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(pentylsulfamoyl)benzamide?
The IUPAC name of N-cyclopropyl-3-(pentylsulfamoyl)benzamide (CID 109062314) is N-cyclopropyl-3-(pentylsulfamoyl)benzamide.
What is the SMILES notation for N-cyclopropyl-3-(pentylsulfamoyl)benzamide?
The canonical SMILES for N-cyclopropyl-3-(pentylsulfamoyl)benzamide is CCCCCNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-3-(pentylsulfamoyl)benzamide?
The InChIKey is DBJYMKZAXNYAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-2-3-4-10-16-21(19,20)14-7-5-6-12(11-14)15(18)17-13-8-9-13/h5-7,11,13,16H,2-4,8-10H2,1H3,(H,17,18).
What are the key properties of N-cyclopropyl-3-(pentylsulfamoyl)benzamide?
N-cyclopropyl-3-(pentylsulfamoyl)benzamide has a molecular weight of 310.42 g/mol, XLogP of 2.05, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(pentylsulfamoyl)benzamide is sourced from PubChem (CID 109062314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).