N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide

C9H12N2O4S — CID 167799854

IUPACN-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide
SMILESC=CS(=O)(=O)NCCNC(=O)c1ccco1
InChIInChI=1S/C9H12N2O4S/c1-2-16(13,14)11-6-5-10-9(12)8-4-3-7-15-8/h2-4,7,11H,1,5-6H2,(H,10,12)
InChIKeyQABKYGDSMVFXCM-UHFFFAOYSA-N
MW244.27 g/mol
LogP0.07
Rot. Bonds6

About N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide

N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide (PubChem CID 167799854) has the molecular formula C9H12N2O4S and a molecular weight of 244.27 g/mol. Its IUPAC name is N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide
PubChem CID167799854
Molecular FormulaC9H12N2O4S
Molecular Weight244.27 g/mol
Exact Mass244.05
IUPAC NameN-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide
SMILESC=CS(=O)(=O)NCCNC(=O)c1ccco1
InChIInChI=1S/C9H12N2O4S/c1-2-16(13,14)11-6-5-10-9(12)8-4-3-7-15-8/h2-4,7,11H,1,5-6H2,(H,10,12)
InChIKeyQABKYGDSMVFXCM-UHFFFAOYSA-N
XLogP0.07
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide 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-[2-[(4-ethylsulfonylphenyl)sulfonylamino]ethyl]furan-2-carboxamide
CID 55871013
N-[10-(furan-2-carbonylamino)decyl]furan-2-carboxamide
CID 3147438
N-[2-[(2-chloroacetyl)amino]ethyl]furan-2-carboxamide
CID 108571159
N-[2-[(2,5-difluorophenyl)sulfonylamino]ethyl]furan-2-carboxamide
CID 31820162
N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide
CID 3155965
3-(furan-2-carbonylamino)propanoic acid
CID 762504
N-[2-(pentanoylamino)ethyl]furan-2-carboxamide
CID 33189840
N-[2-[(N'-methylcarbamimidoyl)amino]ethyl]furan-2-carboxamide;hydroiodide
CID 110914716
N-[2-[(4-ethoxyphenyl)sulfonylamino]ethyl]furan-2-carboxamide
CID 31819893
N-[2-(3-aminopropanoylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119278257
N-[2-(3-chloropropanoylamino)ethyl]furan-2-carboxamide
CID 108571149
N-(3-formamidopropyl)furan-2-carboxamide
CID 110461151

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide (CID 167799854) is N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide is C=CS(=O)(=O)NCCNC(=O)c1ccco1.
What is the InChIKey of N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide?
The InChIKey is QABKYGDSMVFXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4S/c1-2-16(13,14)11-6-5-10-9(12)8-4-3-7-15-8/h2-4,7,11H,1,5-6H2,(H,10,12).
What are the key properties of N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide?
N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide has a molecular weight of 244.27 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethenylsulfonylamino)ethyl]furan-2-carboxamide is sourced from PubChem (CID 167799854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).