N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide

C21H26N2O3S — CID 7935127

IUPACN-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCCc1cccc(NC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1
InChIInChI=1S/C21H26N2O3S/c1-2-17-7-6-8-19(15-17)22-21(24)16-18-9-11-20(12-10-18)27(25,26)23-13-4-3-5-14-23/h6-12,15H,2-5,13-14,16H2,1H3,(H,22,24)
InChIKeyMIBHIQHTQORFGN-UHFFFAOYSA-N
MW386.52 g/mol
LogP3.60
Rot. Bonds6

About N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide

N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide (PubChem CID 7935127) has the molecular formula C21H26N2O3S and a molecular weight of 386.52 g/mol. Its IUPAC name is N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
PubChem CID7935127
Molecular FormulaC21H26N2O3S
Molecular Weight386.52 g/mol
Exact Mass386.17
IUPAC NameN-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCCc1cccc(NC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1
InChIInChI=1S/C21H26N2O3S/c1-2-17-7-6-8-19(15-17)22-21(24)16-18-9-11-20(12-10-18)27(25,26)23-13-4-3-5-14-23/h6-12,15H,2-5,13-14,16H2,1H3,(H,22,24)
InChIKeyMIBHIQHTQORFGN-UHFFFAOYSA-N
XLogP3.60
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.52
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)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

N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 7900052
N-[3-[(2-methoxyacetyl)amino]phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 55566421
N-(3-ethylphenyl)-2-(3-piperidin-1-ylsulfonylanilino)acetamide
CID 42996600
N-[3-(azepan-1-ylsulfonyl)phenyl]-2-phenylacetamide
CID 4785250
1-(3-ethylphenyl)-2-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]guanidine;hydroiodide
CID 111072462
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-methylphenyl)acetamide
CID 1291427
N-(2-ethyl-6-methylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 7900185
1-[[3-[[2-(4-piperidin-1-ylsulfonylphenyl)acetyl]amino]phenyl]methyl]pyrrolidine-2-carboxamide
CID 55984867
2-(4-piperidin-1-ylsulfonylphenyl)-N-[[3-[(2-pyrazol-1-ylacetyl)amino]phenyl]methyl]acetamide
CID 55978727
2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(3-ethylphenyl)acetamide
CID 9104917
N-[3-(morpholine-4-carbonyl)phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 55748941
N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 55825158

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
The IUPAC name of N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide (CID 7935127) is N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide.
What is the SMILES notation for N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
The canonical SMILES for N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide is CCc1cccc(NC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1.
What is the InChIKey of N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
The InChIKey is MIBHIQHTQORFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3S/c1-2-17-7-6-8-19(15-17)22-21(24)16-18-9-11-20(12-10-18)27(25,26)23-13-4-3-5-14-23/h6-12,15H,2-5,13-14,16H2,1H3,(H,22,24).
What are the key properties of N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide has a molecular weight of 386.52 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 7935127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).