N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide

C19H25N3O5S — CID 26423283

IUPACN-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)CCNC(=O)c2ccco2)cc1
InChIInChI=1S/C19H25N3O5S/c1-3-22(4-2)28(25,26)16-9-7-15(8-10-16)14-21-18(23)11-12-20-19(24)17-6-5-13-27-17/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyAKYPXBZSTUVZKA-UHFFFAOYSA-N
MW407.49 g/mol
LogP1.75
Rot. Bonds10

About N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide

N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide (PubChem CID 26423283) has the molecular formula C19H25N3O5S and a molecular weight of 407.49 g/mol. Its IUPAC name is N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide
PubChem CID26423283
Molecular FormulaC19H25N3O5S
Molecular Weight407.49 g/mol
Exact Mass407.15
IUPAC NameN-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)CCNC(=O)c2ccco2)cc1
InChIInChI=1S/C19H25N3O5S/c1-3-22(4-2)28(25,26)16-9-7-15(8-10-16)14-21-18(23)11-12-20-19(24)17-6-5-13-27-17/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyAKYPXBZSTUVZKA-UHFFFAOYSA-N
XLogP1.75
TPSA108.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.49
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[[2-[[4-(diethylsulfamoyl)phenyl]methylamino]-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 24549162
N-[2-[[5-(diethylsulfamoyl)-2-fluorobenzoyl]amino]ethyl]furan-2-carboxamide
CID 34446965
N-[4-[2-(diethylamino)-5-(diethylsulfamoyl)anilino]-4-oxobutyl]furan-2-carboxamide
CID 39753944
1-benzyl-3-[[4-(diethylsulfamoyl)phenyl]methyl]urea
CID 41249851
3-[4-(diethylsulfamoyl)phenyl]-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide
CID 78866038
N-[3-(4-ethylsulfonylanilino)-3-oxopropyl]furan-2-carboxamide
CID 46693911
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-(4-fluorophenyl)propanamide
CID 31747284
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-[(4-propan-2-ylphenyl)sulfonylamino]propanamide
CID 24549159
N-[3-oxo-3-[[4-(propan-2-ylcarbamoylamino)phenyl]methylamino]propyl]furan-2-carboxamide
CID 46456452
N-[[4-(diethylsulfamoyl)phenyl]methyl]-4-thiophen-2-ylbutanamide
CID 9474553
3-[4-(diethylsulfamoyl)phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 33281109
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(3-methoxyphenyl)acetamide
CID 26423088

Frequently Asked Questions

What is the IUPAC name of N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide?
The IUPAC name of N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide (CID 26423283) is N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide is CCN(CC)S(=O)(=O)c1ccc(CNC(=O)CCNC(=O)c2ccco2)cc1.
What is the InChIKey of N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide?
The InChIKey is AKYPXBZSTUVZKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O5S/c1-3-22(4-2)28(25,26)16-9-7-15(8-10-16)14-21-18(23)11-12-20-19(24)17-6-5-13-27-17/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide?
N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide has a molecular weight of 407.49 g/mol, XLogP of 1.75, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[4-(diethylsulfamoyl)phenyl]methylamino]-3-oxopropyl]furan-2-carboxamide is sourced from PubChem (CID 26423283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).