N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide

C19H18N2O4S — CID 4560723

IUPACN-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCc3ccco3)c2)c1
InChIInChI=1S/C19H18N2O4S/c1-14-5-2-6-15(11-14)19(22)21-16-7-3-9-18(12-16)26(23,24)20-13-17-8-4-10-25-17/h2-12,20H,13H2,1H3,(H,21,22)
InChIKeyADWFJVAUGUQDHL-UHFFFAOYSA-N
MW370.43 g/mol
LogP3.32
Rot. Bonds6

About N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide

N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide (PubChem CID 4560723) has the molecular formula C19H18N2O4S and a molecular weight of 370.43 g/mol. Its IUPAC name is N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide
PubChem CID4560723
Molecular FormulaC19H18N2O4S
Molecular Weight370.43 g/mol
Exact Mass370.10
IUPAC NameN-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCc3ccco3)c2)c1
InChIInChI=1S/C19H18N2O4S/c1-14-5-2-6-15(11-14)19(22)21-16-7-3-9-18(12-16)26(23,24)20-13-17-8-4-10-25-17/h2-12,20H,13H2,1H3,(H,21,22)
InChIKeyADWFJVAUGUQDHL-UHFFFAOYSA-N
XLogP3.32
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 2987883
4-{[(3-fluorophenyl)sulfonyl]amino}-N-(2-furylmethyl)benzamide
CID 984669
N-(furan-2-ylmethyl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
CID 2704666
4-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide
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(1-Anilino-1-oxopropan-2-yl) 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 4791564
3-chloro-N-[3-(furan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 5206502
[2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
CID 5798111
3-{[(2-furylmethyl)amino]sulfonyl}-N-phenylbenzamide
CID 1368140
3-[(4-Phenyl-1-piperazinyl)sulfonyl]benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester
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CID 3435304

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide?
The IUPAC name of N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide (CID 4560723) is N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide.
What is the SMILES notation for N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide?
The canonical SMILES for N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide is Cc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCc3ccco3)c2)c1.
What is the InChIKey of N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide?
The InChIKey is ADWFJVAUGUQDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S/c1-14-5-2-6-15(11-14)19(22)21-16-7-3-9-18(12-16)26(23,24)20-13-17-8-4-10-25-17/h2-12,20H,13H2,1H3,(H,21,22).
What are the key properties of N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide?
N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide has a molecular weight of 370.43 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-3-methylbenzamide is sourced from PubChem (CID 4560723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).