N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide

C14H20N2O3S — CID 35203349

IUPACN-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C)cc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C14H20N2O3S/c1-11-6-7-13(15-12(2)17)14(10-11)20(18,19)16-8-4-3-5-9-16/h6-7,10H,3-5,8-9H2,1-2H3,(H,15,17)
InChIKeyYXNILXRMYNCVRS-UHFFFAOYSA-N
MW296.39 g/mol
LogP2.13
Rot. Bonds3

About N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide

N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide (PubChem CID 35203349) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide
PubChem CID35203349
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C)cc1S(=O)(=O)N1CCCCC1
InChIInChI=1S/C14H20N2O3S/c1-11-6-7-13(15-12(2)17)14(10-11)20(18,19)16-8-4-3-5-9-16/h6-7,10H,3-5,8-9H2,1-2H3,(H,15,17)
InChIKeyYXNILXRMYNCVRS-UHFFFAOYSA-N
XLogP2.13
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide
CID 50876397
N-[4-methyl-2-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]sulfonylphenyl]acetamide
CID 46287370
N-[4-methyl-2-[4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidin-1-yl]sulfonylphenyl]acetamide
CID 53083190
[2-(4-methyl-2-piperidin-1-ylsulfonylanilino)-2-oxoethyl] 2-hydroxy-6-oxo-1H-pyridine-4-carboxylate
CID 23799275
3-(azepan-1-ylsulfonyl)-N-(2-bromo-4-methylphenyl)-4-chlorobenzamide
CID 4800375
N-(2,4-dimethylphenyl)-5-methyl-4-pyrrolidin-1-ylsulfonylthiophene-2-carboxamide
CID 6502748
N-[2-[4-[1-(4-fluorophenyl)-6-oxopyridazin-3-yl]piperazin-1-yl]sulfonyl-4-methylphenyl]acetamide
CID 53081527
N-[4-methyl-2-[3-(4-oxoquinazolin-3-yl)piperidin-1-yl]sulfonylphenyl]acetamide
CID 121193506
N-(2,5-dimethylphenyl)-1,5-dimethyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide
CID 53068882
N-(2,4-dimethylphenyl)-1-(2,5-dimethylphenyl)sulfonylpiperidine-3-carboxamide
CID 133254937
N-(2-nitro-4-piperidin-1-ylsulfonylphenyl)acetamide
CID 14226695
N-[4-methyl-2-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperazin-1-yl]sulfonylphenyl]acetamide
CID 53053550

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide?
The IUPAC name of N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide (CID 35203349) is N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide.
What is the SMILES notation for N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide?
The canonical SMILES for N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide is CC(=O)Nc1ccc(C)cc1S(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide?
The InChIKey is YXNILXRMYNCVRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-11-6-7-13(15-12(2)17)14(10-11)20(18,19)16-8-4-3-5-9-16/h6-7,10H,3-5,8-9H2,1-2H3,(H,15,17).
What are the key properties of N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide?
N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide has a molecular weight of 296.39 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-piperidin-1-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 35203349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).