N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide

C14H20N2O3S — CID 60905854

IUPACN-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide
SMILESNS(=O)(=O)c1ccc(CCCNC(=O)C2CCC2)cc1
InChIInChI=1S/C14H20N2O3S/c15-20(18,19)13-8-6-11(7-9-13)3-2-10-16-14(17)12-4-1-5-12/h6-9,12H,1-5,10H2,(H,16,17)(H2,15,18,19)
InChIKeySTHPXVCKODDGPM-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.18
Rot. Bonds6

About N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide

N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide (PubChem CID 60905854) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide
PubChem CID60905854
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide
SMILESNS(=O)(=O)c1ccc(CCCNC(=O)C2CCC2)cc1
InChIInChI=1S/C14H20N2O3S/c15-20(18,19)13-8-6-11(7-9-13)3-2-10-16-14(17)12-4-1-5-12/h6-9,12H,1-5,10H2,(H,16,17)(H2,15,18,19)
InChIKeySTHPXVCKODDGPM-UHFFFAOYSA-N
XLogP1.18
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide 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-[(4-sulfamoylphenyl)methyl]cycloheptanecarboxamide
CID 10470657
N-[2-(4-sulfamoylphenyl)ethyl]cyclopent-3-ene-1-carboxamide
CID 64766938
N-[3-(4-chlorophenyl)propyl]cyclopentanecarboxamide
CID 100733512
1-piperidin-1-ylsulfonyl-N-[2-(4-sulfamoylphenyl)ethyl]piperidine-3-carboxamide
CID 22552986
2-methyl-N-[3-(4-sulfamoylphenyl)propyl]propanamide
CID 60905744
N-[3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 100652408
2-chloro-N-[3-(4-sulfamoylphenyl)propyl]benzamide
CID 110293759
4-[3-(cyclopropylsulfonylamino)propyl]benzenesulfonamide
CID 64553058
N-[2-(4-methylsulfonylphenyl)ethyl]cyclopropanecarboxamide
CID 110790600
3,3,3-trifluoro-N-[3-(4-sulfamoylphenyl)propyl]propanamide
CID 60906071
N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]cyclohexanecarboxamide
CID 30148136
3-methyl-N-[2-(4-sulfamoylphenyl)ethyl]oxolane-2-carboxamide
CID 81425700

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide?
The IUPAC name of N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide (CID 60905854) is N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide?
The canonical SMILES for N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide is NS(=O)(=O)c1ccc(CCCNC(=O)C2CCC2)cc1.
What is the InChIKey of N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide?
The InChIKey is STHPXVCKODDGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c15-20(18,19)13-8-6-11(7-9-13)3-2-10-16-14(17)12-4-1-5-12/h6-9,12H,1-5,10H2,(H,16,17)(H2,15,18,19).
What are the key properties of N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide?
N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide has a molecular weight of 296.39 g/mol, XLogP of 1.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-sulfamoylphenyl)propyl]cyclobutanecarboxamide is sourced from PubChem (CID 60905854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).