N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide

C23H25N3O4S — CID 26136527

IUPACN-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide
SMILESO=C(NC1CCCC1)c1cc(NCc2ccoc2)cc(S(=O)(=O)Nc2ccccc2)c1
InChIInChI=1S/C23H25N3O4S/c27-23(25-19-6-4-5-7-19)18-12-21(24-15-17-10-11-30-16-17)14-22(13-18)31(28,29)26-20-8-2-1-3-9-20/h1-3,8-14,16,19,24,26H,4-7,15H2,(H,25,27)
InChIKeyHCMNEBNTECLZRG-UHFFFAOYSA-N
MW439.54 g/mol
LogP4.36
Rot. Bonds8

About N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide

N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide (PubChem CID 26136527) has the molecular formula C23H25N3O4S and a molecular weight of 439.54 g/mol. Its IUPAC name is N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide
PubChem CID26136527
Molecular FormulaC23H25N3O4S
Molecular Weight439.54 g/mol
Exact Mass439.16
IUPAC NameN-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide
SMILESO=C(NC1CCCC1)c1cc(NCc2ccoc2)cc(S(=O)(=O)Nc2ccccc2)c1
InChIInChI=1S/C23H25N3O4S/c27-23(25-19-6-4-5-7-19)18-12-21(24-15-17-10-11-30-16-17)14-22(13-18)31(28,29)26-20-8-2-1-3-9-20/h1-3,8-14,16,19,24,26H,4-7,15H2,(H,25,27)
InChIKeyHCMNEBNTECLZRG-UHFFFAOYSA-N
XLogP4.36
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.54
LogP ≤ 54.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-3-[(5-methylthiophen-2-yl)methylamino]-5-(phenylsulfamoyl)benzamide
CID 26232184
N-(furan-3-ylmethyl)-4-(phenylsulfamoyl)benzamide
CID 55700082
4-(benzenesulfonamido)-N-cyclooctylbenzamide
CID 24635133
3-(benzenesulfonamido)-N-cyclopropylbenzamide
CID 17465618
N-cyclopentyl-4-[(4-phenylphenyl)sulfonylamino]benzamide
CID 46386307
N-(2-acetamidoethyl)-3-(dimethylsulfamoyl)-5-(furan-3-ylmethylamino)benzamide
CID 26222863
4-(cyclopentylsulfamoyl)-N-(furan-3-ylmethyl)benzamide
CID 70751779
N-(furan-3-ylmethyl)aniline
CID 18938795
3-(cyclohexylmethylamino)-N-(2-imidazol-1-ylethyl)-5-(phenylsulfamoyl)benzamide
CID 26230555
1-cyclohexyl-3-(furan-3-ylmethyl)urea
CID 47236948
N-cyclohexyl-3-[(4-fluorophenyl)sulfamoyl]benzamide
CID 27670788
N-cyclopropyl-3-[(4-ethylphenyl)sulfamoyl]benzamide
CID 109062324

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide?
The IUPAC name of N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide (CID 26136527) is N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide.
What is the SMILES notation for N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide?
The canonical SMILES for N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide is O=C(NC1CCCC1)c1cc(NCc2ccoc2)cc(S(=O)(=O)Nc2ccccc2)c1.
What is the InChIKey of N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide?
The InChIKey is HCMNEBNTECLZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O4S/c27-23(25-19-6-4-5-7-19)18-12-21(24-15-17-10-11-30-16-17)14-22(13-18)31(28,29)26-20-8-2-1-3-9-20/h1-3,8-14,16,19,24,26H,4-7,15H2,(H,25,27).
What are the key properties of N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide?
N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide has a molecular weight of 439.54 g/mol, XLogP of 4.36, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(furan-3-ylmethylamino)-5-(phenylsulfamoyl)benzamide is sourced from PubChem (CID 26136527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).