2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide

C17H17Cl2N3O3S — CID 19257517

IUPAC2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1cc(S(=O)(=O)NC2CCCC2)c(Cl)cc1Cl
InChIInChI=1S/C17H17Cl2N3O3S/c18-14-9-15(19)16(26(24,25)22-11-4-1-2-5-11)8-13(14)17(23)21-12-6-3-7-20-10-12/h3,6-11,22H,1-2,4-5H2,(H,21,23)
InChIKeyJGKFZOURBJVVBD-UHFFFAOYSA-N
MW414.31 g/mol
LogP3.86
Rot. Bonds5

About 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide

2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide (PubChem CID 19257517) has the molecular formula C17H17Cl2N3O3S and a molecular weight of 414.31 g/mol. Its IUPAC name is 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide
PubChem CID19257517
Molecular FormulaC17H17Cl2N3O3S
Molecular Weight414.31 g/mol
Exact Mass413.04
IUPAC Name2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1cc(S(=O)(=O)NC2CCCC2)c(Cl)cc1Cl
InChIInChI=1S/C17H17Cl2N3O3S/c18-14-9-15(19)16(26(24,25)22-11-4-1-2-5-11)8-13(14)17(23)21-12-6-3-7-20-10-12/h3,6-11,22H,1-2,4-5H2,(H,21,23)
InChIKeyJGKFZOURBJVVBD-UHFFFAOYSA-N
XLogP3.86
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.31
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dichloro-5-(cyclohexylsulfamoyl)-N-phenylbenzamide
CID 1356387
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-(4-fluorophenyl)benzamide
CID 19257463
2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide
CID 2996026
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 19257437
2,4-dichloro-5-(dimethylsulfamoyl)-N-pyridin-3-ylbenzamide
CID 1260020
N-(4-acetamidophenyl)-2,4-dichloro-5-(cyclopropylsulfamoyl)benzamide
CID 19257569
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-(pyridin-2-ylmethyl)benzamide
CID 19257505
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]benzamide
CID 24610777
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 5295477
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(3-fluoro-4-methylphenyl)benzamide
CID 30866994
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(3,4-dimethoxyphenyl)benzamide
CID 19258290
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-(2,5-dimethoxyphenyl)benzamide
CID 19257456

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide?
The IUPAC name of 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide (CID 19257517) is 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1cc(S(=O)(=O)NC2CCCC2)c(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide?
The InChIKey is JGKFZOURBJVVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2N3O3S/c18-14-9-15(19)16(26(24,25)22-11-4-1-2-5-11)8-13(14)17(23)21-12-6-3-7-20-10-12/h3,6-11,22H,1-2,4-5H2,(H,21,23).
What are the key properties of 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide?
2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide has a molecular weight of 414.31 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-(cyclopentylsulfamoyl)-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 19257517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).