1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide

C18H25ClN2O3S — CID 126767287

IUPAC1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide
SMILESO=C(Cc1ccccc1Cl)N1CCCC(S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C18H25ClN2O3S/c19-17-10-4-1-6-14(17)12-18(22)21-11-5-9-16(13-21)25(23,24)20-15-7-2-3-8-15/h1,4,6,10,15-16,20H,2-3,5,7-9,11-13H2
InChIKeyMUVDUQHHVXGYRH-UHFFFAOYSA-N
MW384.93 g/mol
LogP2.74
Rot. Bonds5

About 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide

1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide (PubChem CID 126767287) has the molecular formula C18H25ClN2O3S and a molecular weight of 384.93 g/mol. Its IUPAC name is 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide.

Molecular Properties

Compound Name1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide
PubChem CID126767287
Molecular FormulaC18H25ClN2O3S
Molecular Weight384.93 g/mol
Exact Mass384.13
IUPAC Name1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide
SMILESO=C(Cc1ccccc1Cl)N1CCCC(S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C18H25ClN2O3S/c19-17-10-4-1-6-14(17)12-18(22)21-11-5-9-16(13-21)25(23,24)20-15-7-2-3-8-15/h1,4,6,10,15-16,20H,2-3,5,7-9,11-13H2
InChIKeyMUVDUQHHVXGYRH-UHFFFAOYSA-N
XLogP2.74
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.93
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3R)-3-aminopiperidin-1-yl]-2-(2-chlorophenyl)ethanone
CID 102978347
1-[3-(benzenesulfonyl)pyrrolidin-1-yl]-2-(2-chlorophenyl)ethanone
CID 71805583
(3S)-N-cyclopentyl-1-(pyridine-2-carbonyl)piperidine-3-sulfonamide
CID 97348588
4-[3-(cyclopentylsulfamoyl)piperidin-1-yl]-4-oxobutanoic acid
CID 120551607
N-[1-[2-(2-chlorophenyl)acetyl]piperidin-4-yl]propane-1-sulfonamide
CID 38822160
1-(2-chloropyridine-4-carbonyl)-N-cyclopentylpiperidine-3-sulfonamide
CID 75476198
1-(3-bromopyrrolidin-1-yl)-2-(2-chlorophenyl)ethanone
CID 80677513
1-[3-(2-chloroethyl)piperidin-1-yl]-2-(2-chlorophenyl)ethanone
CID 63396274
(3R)-N-cyclopentyl-1-[2-(2-ethyl-1,3-thiazol-4-yl)acetyl]piperidine-3-sulfonamide
CID 97348515
2-(2-chlorophenyl)-1-[(3S)-3-[(dimethylamino)methyl]piperidin-1-yl]ethanone
CID 94796002
(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide
CID 97348594
3-(cyclopentylsulfamoyl)-N-(2,6-difluorophenyl)piperidine-1-carboxamide
CID 75476010

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide?
The IUPAC name of 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide (CID 126767287) is 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide.
What is the SMILES notation for 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide?
The canonical SMILES for 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide is O=C(Cc1ccccc1Cl)N1CCCC(S(=O)(=O)NC2CCCC2)C1.
What is the InChIKey of 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide?
The InChIKey is MUVDUQHHVXGYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2O3S/c19-17-10-4-1-6-14(17)12-18(22)21-11-5-9-16(13-21)25(23,24)20-15-7-2-3-8-15/h1,4,6,10,15-16,20H,2-3,5,7-9,11-13H2.
What are the key properties of 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide?
1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide has a molecular weight of 384.93 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide is sourced from PubChem (CID 126767287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).