(E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide

C16H19NO3S — CID 71796423

IUPAC(E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide
SMILESCc1ccc(/C=C/S(=O)(=O)NC(C)Cc2ccco2)cc1
InChIInChI=1S/C16H19NO3S/c1-13-5-7-15(8-6-13)9-11-21(18,19)17-14(2)12-16-4-3-10-20-16/h3-11,14,17H,12H2,1-2H3/b11-9+
InChIKeyZOBOIHXDCLIBOQ-PKNBQFBNSA-N
MW305.40 g/mol
LogP3.11
Rot. Bonds6

About (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide

(E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide (PubChem CID 71796423) has the molecular formula C16H19NO3S and a molecular weight of 305.40 g/mol. Its IUPAC name is (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide.

Molecular Properties

Compound Name(E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide
PubChem CID71796423
Molecular FormulaC16H19NO3S
Molecular Weight305.40 g/mol
Exact Mass305.11
IUPAC Name(E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide
SMILESCc1ccc(/C=C/S(=O)(=O)NC(C)Cc2ccco2)cc1
InChIInChI=1S/C16H19NO3S/c1-13-5-7-15(8-6-13)9-11-21(18,19)17-14(2)12-16-4-3-10-20-16/h3-11,14,17H,12H2,1-2H3/b11-9+
InChIKeyZOBOIHXDCLIBOQ-PKNBQFBNSA-N
XLogP3.11
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenyl)-N-(4-oxo-4-phenylbutan-2-yl)ethenesulfonamide
CID 71846487
N-[1-(furan-2-yl)propan-2-yl]-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 55620096
N-[(2R)-1-(furan-2-yl)propan-2-yl]-5-methylthiophene-2-sulfonamide
CID 34161122
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966
3-[1-(furan-2-yl)propan-2-ylsulfamoyl]propanoic acid
CID 43708955
3-N-[(2R)-1-(furan-2-yl)propan-2-yl]benzene-1,3-disulfonamide
CID 97020376
N-[(2S)-1-hydroxypropan-2-yl]-2-phenylethenesulfonamide
CID 71873114
2-[1-(furan-2-yl)propan-2-ylamino]-N-(4-methylphenyl)acetamide
CID 61043887
1-(4-fluorophenyl)-N-[(2S)-1-(furan-2-yl)propan-2-yl]methanesulfonamide
CID 34161180
N-[1-(furan-2-yl)propan-2-yl]-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 54913578
N-[1-(furan-2-yl)propan-2-yl]-4-(methylaminomethyl)benzenesulfonamide
CID 61470755
N-[1-(furan-2-yl)propan-2-yl]-3-hydroxybenzenesulfonamide
CID 81258780

Frequently Asked Questions

What is the IUPAC name of (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide?
The IUPAC name of (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide (CID 71796423) is (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide.
What is the SMILES notation for (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide?
The canonical SMILES for (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide is Cc1ccc(/C=C/S(=O)(=O)NC(C)Cc2ccco2)cc1.
What is the InChIKey of (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide?
The InChIKey is ZOBOIHXDCLIBOQ-PKNBQFBNSA-N. The full InChI is InChI=1S/C16H19NO3S/c1-13-5-7-15(8-6-13)9-11-21(18,19)17-14(2)12-16-4-3-10-20-16/h3-11,14,17H,12H2,1-2H3/b11-9+.
What are the key properties of (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide?
(E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide has a molecular weight of 305.40 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[1-(furan-2-yl)propan-2-yl]-2-(4-methylphenyl)ethenesulfonamide is sourced from PubChem (CID 71796423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).