N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide

C14H18Cl2N2O3S — CID 1315364

IUPACN-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide
SMILESCN(CC(=O)NC1CCCC1)S(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H18Cl2N2O3S/c1-18(9-14(19)17-11-4-2-3-5-11)22(20,21)13-8-10(15)6-7-12(13)16/h6-8,11H,2-5,9H2,1H3,(H,17,19)
InChIKeyPBTOOBWOBTZZQG-UHFFFAOYSA-N
MW365.28 g/mol
LogP2.67
Rot. Bonds5

About N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide

N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide (PubChem CID 1315364) has the molecular formula C14H18Cl2N2O3S and a molecular weight of 365.28 g/mol. Its IUPAC name is N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide
PubChem CID1315364
Molecular FormulaC14H18Cl2N2O3S
Molecular Weight365.28 g/mol
Exact Mass364.04
IUPAC NameN-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide
SMILESCN(CC(=O)NC1CCCC1)S(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H18Cl2N2O3S/c1-18(9-14(19)17-11-4-2-3-5-11)22(20,21)13-8-10(15)6-7-12(13)16/h6-8,11H,2-5,9H2,1H3,(H,17,19)
InChIKeyPBTOOBWOBTZZQG-UHFFFAOYSA-N
XLogP2.67
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.28
LogP ≤ 52.67
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-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 7918992
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-cycloheptylacetamide
CID 26516511
2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]-N-cyclopentylacetamide
CID 988036
N-cyclopentyl-2-(2,5-dichloro-N-methylsulfonylanilino)acetamide
CID 23883978
2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-methylamino]-N-cyclopropylacetamide
CID 28536702
2-[benzenesulfonyl(methyl)amino]-N-cyclooctylacetamide
CID 2988556
2,5-dichloro-N-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]benzenesulfonamide
CID 8008277
N-(4-aminocyclohexyl)-2-[(4-chlorophenyl)sulfonyl-methylamino]acetamide
CID 119475665
N-(3-chloro-4-fluorophenyl)-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide
CID 45374381
2-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-(2-methylphenyl)acetamide
CID 16583536
2-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-(3,4-dimethylphenyl)acetamide
CID 17027740

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide?
The IUPAC name of N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide (CID 1315364) is N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide is CN(CC(=O)NC1CCCC1)S(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide?
The InChIKey is PBTOOBWOBTZZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O3S/c1-18(9-14(19)17-11-4-2-3-5-11)22(20,21)13-8-10(15)6-7-12(13)16/h6-8,11H,2-5,9H2,1H3,(H,17,19).
What are the key properties of N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide?
N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide has a molecular weight of 365.28 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(2,5-dichlorophenyl)sulfonyl-methylamino]acetamide is sourced from PubChem (CID 1315364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).