5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide

C23H26N2O5S — CID 58892062

IUPAC5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCCC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C)cc1)c1ccc(C)o1
InChIInChI=1S/C23H26N2O5S/c1-5-20(22-13-8-16(3)30-22)24-23(26)19-14-17(29-4)9-12-21(19)25-31(27,28)18-10-6-15(2)7-11-18/h6-14,20,25H,5H2,1-4H3,(H,24,26)
InChIKeyUMAWVLBRXQBNQF-UHFFFAOYSA-N
MW442.54 g/mol
LogP4.59
Rot. Bonds8

About 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide

5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 58892062) has the molecular formula C23H26N2O5S and a molecular weight of 442.54 g/mol. Its IUPAC name is 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID58892062
Molecular FormulaC23H26N2O5S
Molecular Weight442.54 g/mol
Exact Mass442.16
IUPAC Name5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCCC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C)cc1)c1ccc(C)o1
InChIInChI=1S/C23H26N2O5S/c1-5-20(22-13-8-16(3)30-22)24-23(26)19-14-17(29-4)9-12-21(19)25-31(27,28)18-10-6-15(2)7-11-18/h6-14,20,25H,5H2,1-4H3,(H,24,26)
InChIKeyUMAWVLBRXQBNQF-UHFFFAOYSA-N
XLogP4.59
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.54
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-2-[(4-methylphenyl)sulfonylamino]-N-[1-(6-methyl-3-pyridinyl)propyl]benzamide
CID 58892006
3-chloro-N-[(1R)-1-(4-methoxyphenyl)propyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 38002730
N-[1-(1H-indol-3-yl)butan-2-yl]-5-methoxy-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 58892042
2-chloro-N-[(1R)-1-(4-methoxyphenyl)propyl]-5-[(4-methylphenyl)sulfonylamino]benzamide
CID 92680132
N-[1-(furan-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 58892085
N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 92672317
N-[1-(2,4-dimethylphenyl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 132670901
5-methoxy-N-[(1S)-1-phenylpropyl]-2-(propylsulfonylamino)benzamide
CID 58892109
N-[1-(4-methoxy-3-methylphenyl)propyl]-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 133161197
N-[1-(4-methoxyphenyl)-3-methylbutyl]-3-methyl-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 132616821
N-(5-methoxy-2-methylphenyl)-4-methylbenzenesulfonamide
CID 5146130
3-chloro-N-[(1R)-1-(4-methylphenyl)propyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 93486433

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide (CID 58892062) is 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide is CCC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C)cc1)c1ccc(C)o1.
What is the InChIKey of 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is UMAWVLBRXQBNQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O5S/c1-5-20(22-13-8-16(3)30-22)24-23(26)19-14-17(29-4)9-12-21(19)25-31(27,28)18-10-6-15(2)7-11-18/h6-14,20,25H,5H2,1-4H3,(H,24,26).
What are the key properties of 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide?
5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide has a molecular weight of 442.54 g/mol, XLogP of 4.59, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-[1-(5-methylfuran-2-yl)propyl]-2-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 58892062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).