5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide

C19H30N2O4S — CID 110306644

IUPAC5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide
SMILESCOc1ccc(CCCCC(=O)NCCS(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H30N2O4S/c1-25-18-11-9-17(10-12-18)7-3-4-8-19(22)20-13-16-26(23,24)21-14-5-2-6-15-21/h9-12H,2-8,13-16H2,1H3,(H,20,22)
InChIKeyWBIAYVIURUMVNC-UHFFFAOYSA-N
MW382.53 g/mol
LogP2.34
Rot. Bonds10

About 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide

5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide (PubChem CID 110306644) has the molecular formula C19H30N2O4S and a molecular weight of 382.53 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide
PubChem CID110306644
Molecular FormulaC19H30N2O4S
Molecular Weight382.53 g/mol
Exact Mass382.19
IUPAC Name5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide
SMILESCOc1ccc(CCCCC(=O)NCCS(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H30N2O4S/c1-25-18-11-9-17(10-12-18)7-3-4-8-19(22)20-13-16-26(23,24)21-14-5-2-6-15-21/h9-12H,2-8,13-16H2,1H3,(H,20,22)
InChIKeyWBIAYVIURUMVNC-UHFFFAOYSA-N
XLogP2.34
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(4-methoxyphenyl)-5-oxo-N-(2-piperidin-1-ylsulfonylethyl)pentanamide
CID 110306650
N-(4-methoxyphenyl)-5-piperidin-1-ylsulfonylpentanamide
CID 110299866
N-[2-(azepan-1-ylsulfonyl)ethyl]-3-phenylpropanamide
CID 110346023
N-[2-(3-methoxyphenyl)ethyl]-3-piperidin-1-ylsulfonylpropanamide
CID 110342622
N-[3-(4-methoxyphenyl)propyl]-3-methylsulfonylpropanamide
CID 110627872
N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-5-(4-methoxyphenyl)pentanamide
CID 110306347
2-(3,4-dimethoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)acetamide
CID 110287567
N-[3-[4-(azepan-1-yl)phenyl]propyl]-3-(4-methoxyphenyl)propanamide
CID 16889766
N-(3-acetamidopropyl)-5-(4-methoxyphenyl)pentanamide
CID 110309527
N-[2-(azepan-1-ylsulfonyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 110346040
5-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide
CID 110297842
5-(4-methoxyphenyl)-N-(3-methylbutyl)pentanamide
CID 110297852

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide?
The IUPAC name of 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide (CID 110306644) is 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide?
The canonical SMILES for 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide is COc1ccc(CCCCC(=O)NCCS(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide?
The InChIKey is WBIAYVIURUMVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O4S/c1-25-18-11-9-17(10-12-18)7-3-4-8-19(22)20-13-16-26(23,24)21-14-5-2-6-15-21/h9-12H,2-8,13-16H2,1H3,(H,20,22).
What are the key properties of 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide?
5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide has a molecular weight of 382.53 g/mol, XLogP of 2.34, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-N-(2-piperidin-1-ylsulfonylethyl)pentanamide is sourced from PubChem (CID 110306644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).