2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide

C13H17Cl2N3O3S — CID 86915412

IUPAC2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C13H17Cl2N3O3S/c14-9-5-10(15)7-12(6-9)22(20,21)17-11-1-3-18(4-2-11)8-13(16)19/h5-7,11,17H,1-4,8H2,(H2,16,19)
InChIKeyNHBQJNPXHXDEPP-UHFFFAOYSA-N
MW366.27 g/mol
LogP1.22
Rot. Bonds5

About 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide

2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide (PubChem CID 86915412) has the molecular formula C13H17Cl2N3O3S and a molecular weight of 366.27 g/mol. Its IUPAC name is 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide
PubChem CID86915412
Molecular FormulaC13H17Cl2N3O3S
Molecular Weight366.27 g/mol
Exact Mass365.04
IUPAC Name2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C13H17Cl2N3O3S/c14-9-5-10(15)7-12(6-9)22(20,21)17-11-1-3-18(4-2-11)8-13(16)19/h5-7,11,17H,1-4,8H2,(H2,16,19)
InChIKeyNHBQJNPXHXDEPP-UHFFFAOYSA-N
XLogP1.22
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.27
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(4-bromophenyl)sulfonylamino]piperidin-1-yl]acetamide
CID 60707706
3,5-dichloro-N-cyclopropylbenzenesulfonamide
CID 26947993
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
CID 18278929
2-[4-[(3,5-difluorophenyl)sulfonylamino]piperidin-1-yl]-N-methylacetamide
CID 34268559
2-[4-(bromomethylsulfonylamino)piperidin-1-yl]acetamide
CID 83084786
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-chlorobenzamide
CID 18133860
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-chloro-2-hydroxybenzamide
CID 134047749
2-[4-[(4-chloro-2-fluorophenyl)methylamino]piperidin-1-yl]acetamide
CID 114841998
2-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-chlorobenzamide
CID 61140773
3-[(3,5-dichlorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 63043849
N-(1-benzylpiperidin-4-yl)-3-chlorobenzenesulfonamide;hydrochloride
CID 18197766
1-(2-amino-2-oxoethyl)-N-[1-(3,5-dichlorophenyl)-2-hydroxyethyl]piperidine-4-carboxamide
CID 70737044

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide (CID 86915412) is 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide is NC(=O)CN1CCC(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1.
What is the InChIKey of 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide?
The InChIKey is NHBQJNPXHXDEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17Cl2N3O3S/c14-9-5-10(15)7-12(6-9)22(20,21)17-11-1-3-18(4-2-11)8-13(16)19/h5-7,11,17H,1-4,8H2,(H2,16,19).
What are the key properties of 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide?
2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide has a molecular weight of 366.27 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3,5-dichlorophenyl)sulfonylamino]piperidin-1-yl]acetamide is sourced from PubChem (CID 86915412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).