1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide

C19H26N2O4S — CID 4795552

IUPAC1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide
SMILESCC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NC3CCCC3)CC2)c1
InChIInChI=1S/C19H26N2O4S/c1-14(22)16-5-4-8-18(13-16)26(24,25)21-11-9-15(10-12-21)19(23)20-17-6-2-3-7-17/h4-5,8,13,15,17H,2-3,6-7,9-12H2,1H3,(H,20,23)
InChIKeyZTIDVUBDZPRASP-UHFFFAOYSA-N
MW378.49 g/mol
LogP2.35
Rot. Bonds5

About 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide

1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide (PubChem CID 4795552) has the molecular formula C19H26N2O4S and a molecular weight of 378.49 g/mol. Its IUPAC name is 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide
PubChem CID4795552
Molecular FormulaC19H26N2O4S
Molecular Weight378.49 g/mol
Exact Mass378.16
IUPAC Name1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide
SMILESCC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NC3CCCC3)CC2)c1
InChIInChI=1S/C19H26N2O4S/c1-14(22)16-5-4-8-18(13-16)26(24,25)21-11-9-15(10-12-21)19(23)20-17-6-2-3-7-17/h4-5,8,13,15,17H,2-3,6-7,9-12H2,1H3,(H,20,23)
InChIKeyZTIDVUBDZPRASP-UHFFFAOYSA-N
XLogP2.35
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.49
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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4-(4-Acetylphenyl)sulfonylpiperazin-2-one
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N-(2-cyclohexylethyl)-4-[4-(prop-2-enoylamino)piperidin-1-yl]sulfonylbenzamide
CID 71460258
N-cyclohexyl-4-methyl-3-(piperidine-1-sulfonyl)benzamide
CID 1068516
N-cyclopentyl-3-(1-piperidinylsulfonyl)benzamide
CID 1262175
3-[(dimethylamino)sulfonyl]-N-(2-phenylethyl)benzamide
CID 1262352
1-[3-[4-(2-Methylpropylsulfamoyl)phenyl]propanoyl]piperidine-4-carboxamide
CID 1287856
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CID 1294349

Frequently Asked Questions

What is the IUPAC name of 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide?
The IUPAC name of 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide (CID 4795552) is 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide is CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NC3CCCC3)CC2)c1.
What is the InChIKey of 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide?
The InChIKey is ZTIDVUBDZPRASP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O4S/c1-14(22)16-5-4-8-18(13-16)26(24,25)21-11-9-15(10-12-21)19(23)20-17-6-2-3-7-17/h4-5,8,13,15,17H,2-3,6-7,9-12H2,1H3,(H,20,23).
What are the key properties of 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide?
1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide has a molecular weight of 378.49 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-acetylphenyl)sulfonyl-N-cyclopentylpiperidine-4-carboxamide is sourced from PubChem (CID 4795552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).