N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide

C19H23N3O3S — CID 9154047

IUPACN-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide
SMILESO=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1)N1CCCCC1
InChIInChI=1S/C19H23N3O3S/c23-19(22-12-5-2-6-13-22)21-15-18(16-8-7-11-20-14-16)26(24,25)17-9-3-1-4-10-17/h1,3-4,7-11,14,18H,2,5-6,12-13,15H2,(H,21,23)/t18-/m0/s1
InChIKeyNYCJYZGSCJJIAM-SFHVURJKSA-N
MW373.48 g/mol
LogP2.79
Rot. Bonds5

About N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide

N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide (PubChem CID 9154047) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide
PubChem CID9154047
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide
SMILESO=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1)N1CCCCC1
InChIInChI=1S/C19H23N3O3S/c23-19(22-12-5-2-6-13-22)21-15-18(16-8-7-11-20-14-16)26(24,25)17-9-3-1-4-10-17/h1,3-4,7-11,14,18H,2,5-6,12-13,15H2,(H,21,23)/t18-/m0/s1
InChIKeyNYCJYZGSCJJIAM-SFHVURJKSA-N
XLogP2.79
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]cyclohexanecarboxamide
CID 9153281
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide
CID 9153361
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-2-methylpropanamide
CID 9153191
N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-N'-cyclohexyloxamide
CID 9154333
N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]pyridine-4-carboxamide
CID 9153775
N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-N'-cyclopentyloxamide
CID 9154296
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-N'-[(2S)-butan-2-yl]oxamide
CID 9154240
N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-2-methylbenzamide
CID 9153385
2-[[2-[[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]amino]-2-oxoacetyl]amino]ethyl-dimethylazanium
CID 9154426
2-[[2-[[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]amino]-2-oxoacetyl]amino]ethyl-dimethylazanium
CID 9154417
N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 21002140
N-[(2S)-2-(4-fluorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 9155547

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide?
The IUPAC name of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide (CID 9154047) is N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide?
The canonical SMILES for N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide is O=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1)N1CCCCC1.
What is the InChIKey of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide?
The InChIKey is NYCJYZGSCJJIAM-SFHVURJKSA-N. The full InChI is InChI=1S/C19H23N3O3S/c23-19(22-12-5-2-6-13-22)21-15-18(16-8-7-11-20-14-16)26(24,25)17-9-3-1-4-10-17/h1,3-4,7-11,14,18H,2,5-6,12-13,15H2,(H,21,23)/t18-/m0/s1.
What are the key properties of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide?
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]piperidine-1-carboxamide is sourced from PubChem (CID 9154047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).