2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide

C19H22ClN3O3S — CID 16809473

IUPAC2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CC1CCCCN1S(=O)(=O)c1ccc(Cl)cc1)NCc1ccccn1
InChIInChI=1S/C19H22ClN3O3S/c20-15-7-9-18(10-8-15)27(25,26)23-12-4-2-6-17(23)13-19(24)22-14-16-5-1-3-11-21-16/h1,3,5,7-11,17H,2,4,6,12-14H2,(H,22,24)
InChIKeyYJQHOICSLGEKDX-UHFFFAOYSA-N
MW407.92 g/mol
LogP2.98
Rot. Bonds6

About 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide

2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 16809473) has the molecular formula C19H22ClN3O3S and a molecular weight of 407.92 g/mol. Its IUPAC name is 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide
PubChem CID16809473
Molecular FormulaC19H22ClN3O3S
Molecular Weight407.92 g/mol
Exact Mass407.11
IUPAC Name2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CC1CCCCN1S(=O)(=O)c1ccc(Cl)cc1)NCc1ccccn1
InChIInChI=1S/C19H22ClN3O3S/c20-15-7-9-18(10-8-15)27(25,26)23-12-4-2-6-17(23)13-19(24)22-14-16-5-1-3-11-21-16/h1,3,5,7-11,17H,2,4,6,12-14H2,(H,22,24)
InChIKeyYJQHOICSLGEKDX-UHFFFAOYSA-N
XLogP2.98
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.92
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(benzenesulfonamido)-N-(2-pyridin-2-ylethyl)propanamide
CID 4878270
2-[(4-chlorophenyl)sulfonyl-prop-2-enylamino]-N-pyridin-3-ylacetamide
CID 4879904
1-(4-chlorophenyl)sulfonyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 649951
1-(4-chlorophenyl)sulfonyl-N-pyridin-3-ylpiperidine-4-carboxamide
CID 6462258
8-(4-Chloro-benzenesulfonylamino)-4-(3-pyridin-3-yl-propyl)-octanoic acid amide
CID 10072535
1-(4-(3,5-Dichlorophenylsulfonyl)piperazin-1-yl)-2-(pyridin-2-yl)ethanone
CID 24945555
4-{[[(4-chlorophenyl)sulfonyl](pyridin-2-ylmethyl)amino]methyl}-N-(cyclopropylmethyl)benzamide
CID 44253168
4-chloro-N-[(3R)-2-oxoazepan-3-yl]-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 44444075
4-chloro-N-[(6-chloro-3-pyridinyl)methyl]-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide
CID 44444077
1-(3-Chloro-4-methyl-benzenesulfonyl)-piperidine-3-carboxylic acid (pyridin-3-ylmethyl)-amide
CID 651826
4-[(4-Chloro-benzenesulfonyl)-methyl-amino]-N-pyridin-4-yl-butyramide
CID 654714
2-{[(4-chlorophenyl)sulfonyl]cyclohexylamino}-N-(3-pyridylmethyl)acetamide
CID 1154648

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide (CID 16809473) is 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide is O=C(CC1CCCCN1S(=O)(=O)c1ccc(Cl)cc1)NCc1ccccn1.
What is the InChIKey of 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is YJQHOICSLGEKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O3S/c20-15-7-9-18(10-8-15)27(25,26)23-12-4-2-6-17(23)13-19(24)22-14-16-5-1-3-11-21-16/h1,3,5,7-11,17H,2,4,6,12-14H2,(H,22,24).
What are the key properties of 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide?
2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 407.92 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 16809473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).