N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide

C11H19N3O4S — CID 119507697

IUPACN-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
SMILESCCNCCNC(=O)c1cc(S(=O)(=O)NC)oc1C
InChIInChI=1S/C11H19N3O4S/c1-4-13-5-6-14-11(15)9-7-10(18-8(9)2)19(16,17)12-3/h7,12-13H,4-6H2,1-3H3,(H,14,15)
InChIKeySOMWFLHKPDVMSY-UHFFFAOYSA-N
MW289.36 g/mol
LogP-0.16
Rot. Bonds7

About N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide

N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide (PubChem CID 119507697) has the molecular formula C11H19N3O4S and a molecular weight of 289.36 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
PubChem CID119507697
Molecular FormulaC11H19N3O4S
Molecular Weight289.36 g/mol
Exact Mass289.11
IUPAC NameN-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
SMILESCCNCCNC(=O)c1cc(S(=O)(=O)NC)oc1C
InChIInChI=1S/C11H19N3O4S/c1-4-13-5-6-14-11(15)9-7-10(18-8(9)2)19(16,17)12-3/h7,12-13H,4-6H2,1-3H3,(H,14,15)
InChIKeySOMWFLHKPDVMSY-UHFFFAOYSA-N
XLogP-0.16
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

7-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]amino]heptanoic acid
CID 119350785
N-[2-(ethylamino)ethyl]-5-(methylsulfamoyl)furan-2-carboxamide
CID 119509422
2-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]-propan-2-ylamino]acetic acid
CID 120518391
2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide
CID 71860079
1-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]amino]cyclobutane-1-carboxylic acid
CID 120531056
5-(dimethylsulfamoyl)-2-methyl-N-[3-(methylamino)propyl]furan-3-carboxamide
CID 119434335
cis-(1S,3R)-3-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 120674746
2-methyl-2-[4-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]amino]phenyl]propanoic acid
CID 120528782
N-[2-(ethylamino)ethyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 62657278
N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
CID 119574590
N-(2-amino-1-cyclopropylethyl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide;hydrochloride
CID 119615923
methyl 2-methyl-5-[2-(propylamino)ethylsulfamoyl]furan-3-carboxylate
CID 120715852

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The IUPAC name of N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide (CID 119507697) is N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide.
What is the SMILES notation for N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The canonical SMILES for N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide is CCNCCNC(=O)c1cc(S(=O)(=O)NC)oc1C.
What is the InChIKey of N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The InChIKey is SOMWFLHKPDVMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4S/c1-4-13-5-6-14-11(15)9-7-10(18-8(9)2)19(16,17)12-3/h7,12-13H,4-6H2,1-3H3,(H,14,15).
What are the key properties of N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide has a molecular weight of 289.36 g/mol, XLogP of -0.16, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide is sourced from PubChem (CID 119507697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).