N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide

C19H23N3O3S — CID 51123416

IUPACN-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NCCS(=O)(=O)c1ccccc1)c1cccnc1N1CCCCC1
InChIInChI=1S/C19H23N3O3S/c23-19(21-12-15-26(24,25)16-8-3-1-4-9-16)17-10-7-11-20-18(17)22-13-5-2-6-14-22/h1,3-4,7-11H,2,5-6,12-15H2,(H,21,23)
InChIKeyDBCNETJUZICOKB-UHFFFAOYSA-N
MW373.48 g/mol
LogP2.28
Rot. Bonds6

About N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide

N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 51123416) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
PubChem CID51123416
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NCCS(=O)(=O)c1ccccc1)c1cccnc1N1CCCCC1
InChIInChI=1S/C19H23N3O3S/c23-19(21-12-15-26(24,25)16-8-3-1-4-9-16)17-10-7-11-20-18(17)22-13-5-2-6-14-22/h1,3-4,7-11H,2,5-6,12-15H2,(H,21,23)
InChIKeyDBCNETJUZICOKB-UHFFFAOYSA-N
XLogP2.28
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-phenylethyl)-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 3417086
N-(2-aminoethyl)-2-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
CID 119383900
N-ethyl-2-piperidin-1-ylpyridine-3-carboxamide
CID 47231439
N-(3-aminopropyl)-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 119407815
N-[2-(2,3-dichlorophenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55799150
N-[2-(2-methoxyphenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55757606
N-[2-(3-methylphenyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 60611627
2-pyrrolidin-1-ylpyridine-3-carboxylic acid
CID 2794739
N-[2-(1H-indol-3-yl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 84576774
2-(azepan-1-yl)-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 84576958
N-[(4-fluorophenyl)methyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 55755699
N-[2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 98365172

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide (CID 51123416) is N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide is O=C(NCCS(=O)(=O)c1ccccc1)c1cccnc1N1CCCCC1.
What is the InChIKey of N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is DBCNETJUZICOKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c23-19(21-12-15-26(24,25)16-8-3-1-4-9-16)17-10-7-11-20-18(17)22-13-5-2-6-14-22/h1,3-4,7-11H,2,5-6,12-15H2,(H,21,23).
What are the key properties of N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide?
N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzenesulfonyl)ethyl]-2-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 51123416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).