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

C19H21ClN2O3S — CID 7900052

IUPACN-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H21ClN2O3S/c20-16-5-4-6-17(14-16)21-19(23)13-15-7-9-18(10-8-15)26(24,25)22-11-2-1-3-12-22/h4-10,14H,1-3,11-13H2,(H,21,23)
InChIKeyLBGRKKJPIIVSRJ-UHFFFAOYSA-N
MW392.91 g/mol
LogP3.70
Rot. Bonds5

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

N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide (PubChem CID 7900052) has the molecular formula C19H21ClN2O3S and a molecular weight of 392.91 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
PubChem CID7900052
Molecular FormulaC19H21ClN2O3S
Molecular Weight392.91 g/mol
Exact Mass392.10
IUPAC NameN-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H21ClN2O3S/c20-16-5-4-6-17(14-16)21-19(23)13-15-7-9-18(10-8-15)26(24,25)22-11-2-1-3-12-22/h4-10,14H,1-3,11-13H2,(H,21,23)
InChIKeyLBGRKKJPIIVSRJ-UHFFFAOYSA-N
XLogP3.70
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.91
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethylphenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 7935127
4-(azepan-1-ylsulfonyl)-N-(3-chlorophenyl)benzamide
CID 2665161
N-[3-[(2-methoxyacetyl)amino]phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 55566421
N-[3-(azepan-1-ylsulfonyl)phenyl]-2-phenylacetamide
CID 4785250
2-(3,4-dichlorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 2425143
1-(3-chlorophenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea
CID 19680441
N-[3-(morpholine-4-carbonyl)phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 55748941
3-(4-chlorophenyl)-N-(3-piperidin-1-ylsulfonylphenyl)propanamide
CID 41484446
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-methylphenyl)acetamide
CID 1291427
N-(3-chlorophenyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)sulfanyl]acetamide
CID 7779532
3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 24554825
N-(5-chloro-2-pyridinyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 51188709

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide (CID 7900052) is N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide is O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
The InChIKey is LBGRKKJPIIVSRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O3S/c20-16-5-4-6-17(14-16)21-19(23)13-15-7-9-18(10-8-15)26(24,25)22-11-2-1-3-12-22/h4-10,14H,1-3,11-13H2,(H,21,23).
What are the key properties of N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide?
N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide has a molecular weight of 392.91 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(4-piperidin-1-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 7900052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).