4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide

C18H17N3O4S — CID 18106954

IUPAC4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide
SMILESCc1ccnc(NC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1
InChIInChI=1S/C18H17N3O4S/c1-13-8-9-19-17(11-13)21-18(22)14-4-6-16(7-5-14)26(23,24)20-12-15-3-2-10-25-15/h2-11,20H,12H2,1H3,(H,19,21,22)
InChIKeyHVIRDQVZISYVNT-UHFFFAOYSA-N
MW371.42 g/mol
LogP2.71
Rot. Bonds6

About 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide

4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide (PubChem CID 18106954) has the molecular formula C18H17N3O4S and a molecular weight of 371.42 g/mol. Its IUPAC name is 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide
PubChem CID18106954
Molecular FormulaC18H17N3O4S
Molecular Weight371.42 g/mol
Exact Mass371.09
IUPAC Name4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide
SMILESCc1ccnc(NC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1
InChIInChI=1S/C18H17N3O4S/c1-13-8-9-19-17(11-13)21-18(22)14-4-6-16(7-5-14)26(23,24)20-12-15-3-2-10-25-15/h2-11,20H,12H2,1H3,(H,19,21,22)
InChIKeyHVIRDQVZISYVNT-UHFFFAOYSA-N
XLogP2.71
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(4-methylpyridin-2-yl)carbamoyl]phenyl]furan-2-carboxamide
CID 1262407
Furan-2-carboxylic acid [4-methyl-5-(3-phenyl-propionylamino)-pyridin-2-yl]-amide
CID 645020
Furan-2-carboxylic acid (6-benzoylamino-4-methyl-pyridin-3-yl)-amide
CID 645254
N-Benzyl-N-{[(furan-2-ylmethyl)-carbamoyl]-methyl}-N'-pyridin-2-yl-succinamide
CID 648888
Furan-2-carboxylic acid (4-methyl-5-phenylacetylamino-pyridin-2-yl)-amide
CID 649833
N-{[(Furan-2-ylmethyl)-carbamoyl]-methyl}-N'-pyridin-2-yl-N-m-tolyl-succinamide
CID 652502
N-(4-Fluoro-benzyl)-N-{[(furan-2-ylmethyl)-carbamoyl]-methyl}-N'-pyridin-2-yl-succinamide
CID 653732
N-Furan-2-ylmethyl-N'-(4-methyl-pyridin-2-yl)-N-(phenethylcarbamoyl-methyl)-succinamide
CID 655291
[2-[(3,5-Dichloro-4-methylpyridin-2-yl)amino]-2-oxoethyl] 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 2078980
[2-[(3,5-Dichloro-2-pyridinyl)amino]-2-oxoethyl] 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 2533346
N'-[2-(benzylamino)-2-oxoethyl]-N'-(furan-2-ylmethyl)-N-(4-methyl-2-pyridinyl)butanediamide
CID 3208427
[1-[(5-Chloropyridin-2-yl)amino]-1-oxopropan-2-yl] 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 3365953

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide?
The IUPAC name of 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide (CID 18106954) is 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide is Cc1ccnc(NC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1.
What is the InChIKey of 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide?
The InChIKey is HVIRDQVZISYVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S/c1-13-8-9-19-17(11-13)21-18(22)14-4-6-16(7-5-14)26(23,24)20-12-15-3-2-10-25-15/h2-11,20H,12H2,1H3,(H,19,21,22).
What are the key properties of 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide?
4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide has a molecular weight of 371.42 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethylsulfamoyl)-N-(4-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 18106954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).