N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide

C19H26N2O4S — CID 17147535

IUPACN-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide
SMILESCCCCCCCC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C19H26N2O4S/c1-2-3-4-5-6-9-19(22)21-16-10-12-18(13-11-16)26(23,24)20-15-17-8-7-14-25-17/h7-8,10-14,20H,2-6,9,15H2,1H3,(H,21,22)
InChIKeyWFWXNVSWMPHODC-UHFFFAOYSA-N
MW378.49 g/mol
LogP4.06
Rot. Bonds11

About N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide

N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide (PubChem CID 17147535) has the molecular formula C19H26N2O4S and a molecular weight of 378.49 g/mol. Its IUPAC name is N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide.

Molecular Properties

Compound NameN-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide
PubChem CID17147535
Molecular FormulaC19H26N2O4S
Molecular Weight378.49 g/mol
Exact Mass378.16
IUPAC NameN-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide
SMILESCCCCCCCC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C19H26N2O4S/c1-2-3-4-5-6-9-19(22)21-16-10-12-18(13-11-16)26(23,24)20-15-17-8-7-14-25-17/h7-8,10-14,20H,2-6,9,15H2,1H3,(H,21,22)
InChIKeyWFWXNVSWMPHODC-UHFFFAOYSA-N
XLogP4.06
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.49
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(furan-2-ylmethylsulfamoyl)phenyl]pentanamide
CID 51154986
N-[4-(benzylsulfamoyl)phenyl]octanamide
CID 4958608
N-(furan-2-ylmethyl)-4-(heptanoylamino)benzamide
CID 54789414
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-[(3-methylphenyl)sulfonylamino]propanamide
CID 4968582
3-(2,5-dioxopyrrolidin-1-yl)-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide
CID 9203705
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]propanamide
CID 8615701
5-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-2-hexoxybenzamide
CID 17170978
2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]acetamide
CID 108806522
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-2-phenoxyacetamide
CID 652012
N-[4-(2-phenylethylsulfamoyl)phenyl]heptanamide
CID 54790596
[4-(furan-2-ylmethylsulfamoyl)phenyl]thiourea
CID 169358880
N-[4-(propylsulfamoyl)phenyl]pentanamide
CID 17321429

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide?
The IUPAC name of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide (CID 17147535) is N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide.
What is the SMILES notation for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide?
The canonical SMILES for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide is CCCCCCCC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide?
The InChIKey is WFWXNVSWMPHODC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O4S/c1-2-3-4-5-6-9-19(22)21-16-10-12-18(13-11-16)26(23,24)20-15-17-8-7-14-25-17/h7-8,10-14,20H,2-6,9,15H2,1H3,(H,21,22).
What are the key properties of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide?
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide has a molecular weight of 378.49 g/mol, XLogP of 4.06, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]octanamide is sourced from PubChem (CID 17147535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).