2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide

C20H22Cl2N2O3S — CID 988036

IUPAC2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide
SMILESO=C(CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl)NC1CCCC1
InChIInChI=1S/C20H22Cl2N2O3S/c21-16-10-11-18(22)19(12-16)28(26,27)24(13-15-6-2-1-3-7-15)14-20(25)23-17-8-4-5-9-17/h1-3,6-7,10-12,17H,4-5,8-9,13-14H2,(H,23,25)
InChIKeyQNXSEWZTAVKRJP-UHFFFAOYSA-N
MW441.38 g/mol
LogP4.24
Rot. Bonds7

About 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide

2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide (PubChem CID 988036) has the molecular formula C20H22Cl2N2O3S and a molecular weight of 441.38 g/mol. Its IUPAC name is 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide
PubChem CID988036
Molecular FormulaC20H22Cl2N2O3S
Molecular Weight441.38 g/mol
Exact Mass440.07
IUPAC Name2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide
SMILESO=C(CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl)NC1CCCC1
InChIInChI=1S/C20H22Cl2N2O3S/c21-16-10-11-18(22)19(12-16)28(26,27)24(13-15-6-2-1-3-7-15)14-20(25)23-17-8-4-5-9-17/h1-3,6-7,10-12,17H,4-5,8-9,13-14H2,(H,23,25)
InChIKeyQNXSEWZTAVKRJP-UHFFFAOYSA-N
XLogP4.24
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-ethylamino]acetamide
CID 2239469
2-[benzyl-(2-fluorophenyl)sulfonylamino]-N-cyclohexylacetamide
CID 2695389
N-benzyl-2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]acetamide
CID 126012482
N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide
CID 1315364
2-[benzenesulfonyl-[(3,4-dichlorophenyl)methyl]amino]-N-cycloheptylacetamide
CID 126026477
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 28544429
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-(3-methylbutyl)acetamide
CID 126392917
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 124538005
2-[(4-chlorophenyl)methyl-(2,4,6-trimethylphenyl)sulfonylamino]-N-cyclopentylacetamide
CID 5177354
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-(2-methoxyphenyl)acetamide
CID 1334485
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-(2,3-dimethylphenyl)acetamide
CID 2290702
2-[(4-chlorophenyl)sulfonyl-[(4-methylphenyl)methyl]amino]-N-cyclopentylacetamide
CID 1072746

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide?
The IUPAC name of 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide (CID 988036) is 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide?
The canonical SMILES for 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide is O=C(CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl)NC1CCCC1.
What is the InChIKey of 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide?
The InChIKey is QNXSEWZTAVKRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N2O3S/c21-16-10-11-18(22)19(12-16)28(26,27)24(13-15-6-2-1-3-7-15)14-20(25)23-17-8-4-5-9-17/h1-3,6-7,10-12,17H,4-5,8-9,13-14H2,(H,23,25).
What are the key properties of 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide?
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide has a molecular weight of 441.38 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide is sourced from PubChem (CID 988036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).