N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide

C16H21N3O4S — CID 9331913

IUPACN-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)Cc1ccco1
InChIInChI=1S/C16H21N3O4S/c1-18(2)24(21,22)15-8-6-13(7-9-15)17-16(20)12-19(3)11-14-5-4-10-23-14/h4-10H,11-12H2,1-3H3,(H,17,20)
InChIKeyUQWFSOKUNRFNIZ-UHFFFAOYSA-N
MW351.43 g/mol
LogP1.60
Rot. Bonds7

About N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide

N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide (PubChem CID 9331913) has the molecular formula C16H21N3O4S and a molecular weight of 351.43 g/mol. Its IUPAC name is N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
PubChem CID9331913
Molecular FormulaC16H21N3O4S
Molecular Weight351.43 g/mol
Exact Mass351.13
IUPAC NameN-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)Cc1ccco1
InChIInChI=1S/C16H21N3O4S/c1-18(2)24(21,22)15-8-6-13(7-9-15)17-16(20)12-19(3)11-14-5-4-10-23-14/h4-10H,11-12H2,1-3H3,(H,17,20)
InChIKeyUQWFSOKUNRFNIZ-UHFFFAOYSA-N
XLogP1.60
TPSA82.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-tert-butylphenyl)-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 31379581
N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9333516
2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 18170938
2-(diethylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 17432578
4-[[2-[furan-2-ylmethyl(methyl)amino]acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 9333882
2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 26603771
N-(4-tert-butylphenyl)-2-[furan-2-ylmethyl-(4-methylphenyl)sulfonylamino]acetamide
CID 2415373
N-[4-(dimethylsulfamoyl)phenyl]-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 9049481
N-[4-(dimethylsulfamoyl)phenyl]furan-2-carboxamide
CID 2672857
2-[benzyl(ethyl)amino]-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 8533359
[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]-[(1S)-1-(furan-2-yl)ethyl]azanium
CID 8919420
2-[furan-2-ylmethyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 9333158

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide?
The IUPAC name of N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide (CID 9331913) is N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide.
What is the SMILES notation for N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide?
The canonical SMILES for N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide is CN(CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)Cc1ccco1.
What is the InChIKey of N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide?
The InChIKey is UQWFSOKUNRFNIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O4S/c1-18(2)24(21,22)15-8-6-13(7-9-15)17-16(20)12-19(3)11-14-5-4-10-23-14/h4-10H,11-12H2,1-3H3,(H,17,20).
What are the key properties of N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide?
N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide has a molecular weight of 351.43 g/mol, XLogP of 1.60, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide is sourced from PubChem (CID 9331913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).