2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide

C16H24ClN3O3S — CID 119557382

IUPAC2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide
SMILESCC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCCC1CCCNC1
InChIInChI=1S/C16H24ClN3O3S/c1-12(16(21)19-10-8-13-3-2-9-18-11-13)20-24(22,23)15-6-4-14(17)5-7-15/h4-7,12-13,18,20H,2-3,8-11H2,1H3,(H,19,21)
InChIKeyXHESQAUXBHGJCL-UHFFFAOYSA-N
MW373.91 g/mol
LogP1.51
Rot. Bonds7

About 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide

2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide (PubChem CID 119557382) has the molecular formula C16H24ClN3O3S and a molecular weight of 373.91 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide
PubChem CID119557382
Molecular FormulaC16H24ClN3O3S
Molecular Weight373.91 g/mol
Exact Mass373.12
IUPAC Name2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide
SMILESCC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCCC1CCCNC1
InChIInChI=1S/C16H24ClN3O3S/c1-12(16(21)19-10-8-13-3-2-9-18-11-13)20-24(22,23)15-6-4-14(17)5-7-15/h4-7,12-13,18,20H,2-3,8-11H2,1H3,(H,19,21)
InChIKeyXHESQAUXBHGJCL-UHFFFAOYSA-N
XLogP1.51
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.91
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminoethyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 119383880
4-chloro-N-[3-methyl-1-oxo-1-(2-piperidin-3-ylethylamino)pentan-2-yl]benzamide
CID 119554960
2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(2-pyrrolidin-3-ylethyl)butanamide
CID 119536771
4-(tert-butylsulfamoyl)-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555746
4-chloro-N-(2-pyrrolidin-3-ylethyl)benzenesulfonamide;hydrochloride
CID 119976932
2-[(4-chlorophenyl)sulfonylamino]-N-[2-(ethylamino)ethyl]propanamide
CID 119507175
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-cycloheptylpropanamide
CID 51122843
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]propanamide
CID 55939921
(2S)-N-(2-bromoprop-2-enyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 47439175
4-methyl-N-(2-piperidin-3-ylethyl)benzenesulfonamide
CID 60895182
4-chloro-N-[1-oxo-1-(piperidin-3-ylmethylamino)propan-2-yl]benzamide;hydrochloride
CID 119464126
4-chloro-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 63628711

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide (CID 119557382) is 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide is CC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCCC1CCCNC1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide?
The InChIKey is XHESQAUXBHGJCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O3S/c1-12(16(21)19-10-8-13-3-2-9-18-11-13)20-24(22,23)15-6-4-14(17)5-7-15/h4-7,12-13,18,20H,2-3,8-11H2,1H3,(H,19,21).
What are the key properties of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide?
2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide has a molecular weight of 373.91 g/mol, XLogP of 1.51, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-piperidin-3-ylethyl)propanamide is sourced from PubChem (CID 119557382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).