4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide

C15H12Cl2N4O4S — CID 69379894

IUPAC4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
SMILESO=C(NCc1ccco1)c1[nH]ncc1NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C15H12Cl2N4O4S/c16-9-3-4-11(17)13(6-9)26(23,24)21-12-8-19-20-14(12)15(22)18-7-10-2-1-5-25-10/h1-6,8,21H,7H2,(H,18,22)(H,19,20)
InChIKeyRADWUEYHCWNCTG-UHFFFAOYSA-N
MW415.26 g/mol
LogP3.04
Rot. Bonds6

About 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide

4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide (PubChem CID 69379894) has the molecular formula C15H12Cl2N4O4S and a molecular weight of 415.26 g/mol. Its IUPAC name is 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
PubChem CID69379894
Molecular FormulaC15H12Cl2N4O4S
Molecular Weight415.26 g/mol
Exact Mass414.00
IUPAC Name4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
SMILESO=C(NCc1ccco1)c1[nH]ncc1NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C15H12Cl2N4O4S/c16-9-3-4-11(17)13(6-9)26(23,24)21-12-8-19-20-14(12)15(22)18-7-10-2-1-5-25-10/h1-6,8,21H,7H2,(H,18,22)(H,19,20)
InChIKeyRADWUEYHCWNCTG-UHFFFAOYSA-N
XLogP3.04
TPSA117.09 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.26
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-4-(methanesulfonamido)-1H-pyrazole-5-carboxamide
CID 69379558
N-(furan-2-ylmethyl)-4-[(4-methoxyphenyl)sulfonylamino]-1H-pyrazole-5-carboxamide
CID 69381406
4-[(2,5-dichlorophenyl)sulfonylamino]-N-propan-2-yl-1H-pyrazole-5-carboxamide
CID 69379969
4-chloro-N-(furan-2-ylmethyl)-3-(methylsulfamoyl)benzamide
CID 4882410
2,5-dichloro-N-(furan-2-ylmethyl)benzamide
CID 690467
4-[(2,4-difluorobenzoyl)amino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
CID 69378466
4-chloro-N-(furan-2-ylmethyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 46422535
4-chloro-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 4234401
4-chloro-N-[(4-chlorophenyl)methyl]-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 36866343
5-N-(2,5-dichlorophenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109104953
6-N-(2,5-dichlorophenyl)-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097197
2,4-dichloro-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 4938422

Frequently Asked Questions

What is the IUPAC name of 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide (CID 69379894) is 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide is O=C(NCc1ccco1)c1[nH]ncc1NS(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
The InChIKey is RADWUEYHCWNCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N4O4S/c16-9-3-4-11(17)13(6-9)26(23,24)21-12-8-19-20-14(12)15(22)18-7-10-2-1-5-25-10/h1-6,8,21H,7H2,(H,18,22)(H,19,20).
What are the key properties of 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide?
4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide has a molecular weight of 415.26 g/mol, XLogP of 3.04, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,5-dichlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 69379894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).