N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide

C13H21N3O5S — CID 110476324

IUPACN-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESCN(C)CCNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C13H21N3O5S/c1-15(2)6-5-14-13(17)11-3-4-12(21-11)22(18,19)16-7-9-20-10-8-16/h3-4H,5-10H2,1-2H3,(H,14,17)
InChIKeyCWSDHMGIHOXGDO-UHFFFAOYSA-N
MW331.39 g/mol
LogP-0.41
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide

N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide (PubChem CID 110476324) has the molecular formula C13H21N3O5S and a molecular weight of 331.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
PubChem CID110476324
Molecular FormulaC13H21N3O5S
Molecular Weight331.39 g/mol
Exact Mass331.12
IUPAC NameN-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESCN(C)CCNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C13H21N3O5S/c1-15(2)6-5-14-13(17)11-3-4-12(21-11)22(18,19)16-7-9-20-10-8-16/h3-4H,5-10H2,1-2H3,(H,14,17)
InChIKeyCWSDHMGIHOXGDO-UHFFFAOYSA-N
XLogP-0.41
TPSA92.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.39
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 35993608
5-morpholin-4-ylsulfonyl-N-(2-phenoxyethyl)furan-2-carboxamide
CID 30233770
N-[2-(dimethylamino)ethyl]-5-(methylsulfamoyl)furan-2-carboxamide
CID 110476323
N-[(5-ethylthiophen-2-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 46466417
N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 50945849
5-morpholin-4-ylsulfonyl-N-(2,4,6-trimethylphenyl)furan-2-carboxamide
CID 39087927
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 112528608
3-[(5-piperidin-1-ylsulfonylfuran-2-carbonyl)amino]propanoic acid
CID 75417895
N-(2-hydroxyphenyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 84578663
5-morpholin-4-ylsulfonyl-N-[(3-phenoxyphenyl)methyl]furan-2-carboxamide
CID 39576917
5-morpholin-4-ylsulfonyl-N-[1-(4-phenylphenyl)ethyl]furan-2-carboxamide
CID 46409252
N-[2-(3,4-diethoxyphenyl)ethyl]-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55630550

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide (CID 110476324) is N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide is CN(C)CCNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The InChIKey is CWSDHMGIHOXGDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O5S/c1-15(2)6-5-14-13(17)11-3-4-12(21-11)22(18,19)16-7-9-20-10-8-16/h3-4H,5-10H2,1-2H3,(H,14,17).
What are the key properties of N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide has a molecular weight of 331.39 g/mol, XLogP of -0.41, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 110476324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).